data_2lqi_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2lqi _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 10.0 ptpp? . . . . . 0 N--CA 1.39 -3.466 0 CA-C-O 121.561 0.696 . . . . 0.0 110.553 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.25 -9.74 24.54 Favored Glycine 0 C--O 1.238 0.376 0 CA-C-N 114.391 -1.277 . . . . 0.0 115.158 -174.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.471 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 66.0 p-90 -68.55 -9.13 47.43 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 117.196 0.498 . . . . 0.0 112.067 178.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.406 ' HD2' ' O ' ' A' ' 4' ' ' LYS . 21.7 p80 -58.54 -24.09 59.84 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-O 120.918 0.389 . . . . 0.0 111.797 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.18 -10.6 59.71 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.171 0.51 . . . . 0.0 110.406 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -105.47 10.88 33.1 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.398 0.618 . . . . 0.0 110.53 -176.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.439 HG21 HD13 ' A' ' 14' ' ' LEU . 7.5 p -139.86 128.57 27.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.407 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.4 p -106.66 162.09 14.06 Favored 'General case' 0 CA--C 1.473 -1.986 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.467 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 0.8 OUTLIER -53.63 -41.58 66.86 Favored 'General case' 0 N--CA 1.422 -1.845 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.596 176.324 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.558 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 6.2 t70 -58.69 -40.85 84.82 Favored 'General case' 0 C--O 1.203 -1.394 0 O-C-N 122.951 0.157 . . . . 0.0 111.225 178.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.439 HD13 HG21 ' A' ' 10' ' ' VAL . 3.1 tm? -69.3 -50.15 49.4 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -175.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.472 ' O ' HG23 ' A' ' 19' ' ' VAL . 13.4 ptm180 -63.79 -46.15 86.5 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.623 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.7 t -67.48 -26.66 66.48 Favored 'General case' 0 CA--C 1.556 1.186 0 CA-C-O 121.033 0.444 . . . . 0.0 110.37 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.558 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 12.3 t60 -68.1 -49.41 61.33 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.494 HD21 HD21 ' A' ' 68' ' ' LEU . 1.2 mp -60.25 -49.55 77.15 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.524 176.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 15' ' ' ARG . 21.4 t -52.13 -43.3 37.82 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.765 0 C-N-CA 124.581 1.153 . . . . 0.0 109.034 177.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -58.51 -44.93 89.65 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 122.751 0.42 . . . . 0.0 110.396 177.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.537 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 2.5 mptp? -65.03 -35.57 81.58 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.576 175.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.452 ' O ' HG21 ' A' ' 26' ' ' ILE . 9.0 mp -55.5 -44.72 76.84 Favored 'General case' 0 CA--C 1.476 -1.897 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.816 176.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.49 ' HA ' HG21 ' A' ' 26' ' ' ILE . 78.6 t -58.77 -47.15 90.06 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.919 0 O-C-N 124.134 0.896 . . . . 0.0 110.688 174.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -56.86 -33.76 67.14 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.986 0.422 . . . . 0.0 111.869 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.87 -45.7 15.14 Favored 'General case' 0 C--O 1.192 -1.943 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 177.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.49 HG21 ' HA ' ' A' ' 23' ' ' VAL . 3.2 tt -71.55 -35.27 55.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 O-C-N 121.105 -0.997 . . . . 0.0 110.218 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -119.2 96.88 50.32 Favored Pre-proline 0 N--CA 1.398 -3.036 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 -179.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.97 96.68 0.1 Allowed 'Trans proline' 0 C--O 1.256 1.408 0 C-N-CA 121.616 1.544 . . . . 0.0 108.444 171.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.7 t -75.81 134.8 71.64 Favored Pre-proline 0 N--CA 1.411 -2.413 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.144 -172.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -73.68 -20.97 19.6 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 122.619 2.213 . . . . 0.0 111.487 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -159.31 144.14 11.45 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 -177.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -57.52 -19.74 38.04 Favored 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 122.512 2.141 . . . . 0.0 114.091 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.43 -11.69 59.91 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 121.122 -0.986 . . . . 0.0 112.162 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.83 -8.1 56.7 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.076 0.941 . . . . 0.0 109.269 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 30.7 mt -90.12 2.1 55.67 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.864 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -133.8 23.94 3.96 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 122.448 1.118 . . . . 0.0 108.144 178.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.657 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 25.4 t70 -98.18 176.43 5.74 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 113.778 -1.556 . . . . 0.0 110.269 -175.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.657 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.55 -23.2 61.72 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 123.387 0.675 . . . . 0.0 111.132 178.5 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.52 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 41.9 ttm180 -72.94 -26.38 61.36 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 176.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.786 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.5 tpp -61.07 -38.62 86.87 Favored 'General case' 0 C--O 1.193 -1.87 0 CA-C-N 114.518 -1.219 . . . . 0.0 112.636 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.523 ' O ' ' HB3' ' A' ' 45' ' ' ALA . 7.2 pt-20 -59.24 -32.07 69.65 Favored 'General case' 0 C--O 1.204 -1.295 0 C-N-CA 118.886 -1.126 . . . . 0.0 110.757 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -75.46 -46.29 33.44 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 123.839 0.855 . . . . 0.0 110.29 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 68.4 mt -63.82 -47.07 82.3 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.793 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.786 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.5 p -72.16 -28.55 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.938 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.58 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -57.06 -47.35 81.19 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 176.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.51 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.6 t80 -61.28 -47.99 83.44 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.833 174.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.452 ' CB ' HG11 ' A' ' 19' ' ' VAL . . . -59.52 -44.2 93.22 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.757 -176.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -62.38 -42.47 99.44 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.433 0.693 . . . . 0.0 111.314 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.51 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 55.8 pttt -69.27 -39.72 78.22 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.297 0.57 . . . . 0.0 110.635 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 49.4 t -69.5 -47.8 70.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.002 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.473 ' OE2' HD23 ' A' ' 68' ' ' LEU . 12.6 mm-40 -60.73 -37.54 82.09 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.559 178.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.87 -39.19 97.19 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.54 -0.755 . . . . 0.0 112.082 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.24 -52.84 63.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.807 0.337 . . . . 0.0 110.515 177.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -68.87 -30.15 68.6 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.44 -47.32 86.63 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 175.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.62 -19.15 55.98 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.298 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.0 t -79.22 -27.83 42.49 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.208 0.528 . . . . 0.0 110.176 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.76 165.29 13.01 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-O 121.627 0.727 . . . . 0.0 112.692 -175.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -116.95 18.41 14.71 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.436 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.8 p -168.45 158.54 9.72 Favored 'General case' 0 CA--C 1.49 -1.34 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 173.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.85 -30.7 65.72 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.969 177.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -58.78 -47.49 84.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.111 -0.949 . . . . 0.0 108.911 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -65.86 -46.41 78.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.392 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -45.07 92.98 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -176.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.455 ' HA ' ' CD2' ' A' ' 68' ' ' LEU . 7.6 t80 -63.55 -39.7 95.09 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.601 178.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -62.7 -55.86 22.94 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.35 -33.14 75.27 Favored 'General case' 0 C--O 1.255 1.39 0 CA-C-O 121.598 0.713 . . . . 0.0 111.482 -175.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.494 HD21 HD21 ' A' ' 18' ' ' LEU . 1.4 pp -73.42 -32.41 64.4 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.909 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.4 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -68.44 -33.97 75.14 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.674 178.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -66.1 -43.16 88.05 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.403 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.494 ' NZ ' ' HB2' ' A' ' 68' ' ' LEU . 1.4 pptp? -65.17 -42.67 93.44 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 119.811 -0.756 . . . . 0.0 111.925 179.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.576 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.1 tt -65.94 -40.42 87.37 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.693 0 CA-C-O 121.006 0.432 . . . . 0.0 110.163 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.514 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 62.6 t80 -57.33 -52.86 63.64 Favored 'General case' 0 C--O 1.272 2.261 0 C-N-CA 124.963 1.305 . . . . 0.0 110.495 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.1 ptpt -64.38 -33.07 75.0 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.225 -178.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.72 -38.31 81.98 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.992 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.585 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 53.0 mt-30 -69.62 -43.86 71.84 Favored 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.626 -175.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.554 ' HB3' ' HZ3' ' A' ' 77' ' ' LYS . 0.2 OUTLIER -70.44 -28.24 64.87 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 118.648 -1.221 . . . . 0.0 112.782 175.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -61.74 -49.41 76.51 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 175.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.4 pp -64.84 -40.45 95.2 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.76 -176.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.423 ' N ' HD11 ' A' ' 79' ' ' LEU . 45.9 mt-10 -62.68 -50.42 71.22 Favored 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 123.665 0.603 . . . . 0.0 112.211 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.5 pt-20 -72.57 -32.09 65.75 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 119.708 -0.797 . . . . 0.0 112.787 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.54 -35.23 80.23 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 . . . . . 0 N--CA 1.447 -0.607 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.027 178.301 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.212 -0.9 0 CA-C-O 120.619 0.247 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.404 ' O ' ' HB3' ' B' ' 118' ' ' ASP . 51.6 tp -67.4 -41.85 84.25 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 175.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.8 m -65.71 -39.46 91.22 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.27 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.5 m -77.37 -20.65 54.45 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.386 0.613 . . . . 0.0 111.375 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.404 ' HB3' ' O ' ' B' ' 115' ' ' LEU . 9.8 t70 . . . . . 0 C--N 1.317 -0.811 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 175.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 26.3 ttp . . . . . 0 C--O 1.201 -1.473 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -14.82 -71.98 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 127.22 2.208 . . . . 0.0 116.711 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 20.2 m -70.5 -38.8 74.36 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 122.01 -0.432 . . . . 0.0 111.623 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 66.8 mt -66.88 -45.95 86.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.406 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 14.7 tt -66.04 -37.21 79.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.349 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -61.29 -52.84 63.02 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.6 t -68.63 -54.06 18.74 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -176.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -80.96 -37.4 29.46 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -173.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 52.7 tp . . . . . 0 N--CA 1.471 0.608 0 CA-C-N 118.205 0.457 . . . . 0.0 109.932 178.319 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.461 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 39.1 mttp . . . . . 0 N--CA 1.433 -1.322 0 CA-C-O 120.86 0.362 . . . . 0.0 110.061 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -67.22 -17.42 68.13 Favored Glycine 0 C--N 1.317 -0.495 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.497 -176.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.461 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 63.1 p-90 -68.19 -10.25 52.96 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.438 ' HB2' ' HH ' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -62.48 -17.61 59.96 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.086 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -81.67 -9.46 59.65 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 121.162 0.506 . . . . 0.0 109.989 177.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.44 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 53.5 m-70 -101.63 9.66 40.9 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.91 -178.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.6 p -140.05 110.86 4.19 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.732 0 CA-C-O 122.24 1.019 . . . . 0.0 109.429 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 m -88.38 161.29 17.17 Favored 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.095 -0.957 . . . . 0.0 108.705 -176.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -36.9 64.83 Favored 'General case' 0 C--O 1.195 -1.81 0 C-N-CA 122.891 0.477 . . . . 0.0 110.17 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -52.09 -46.43 65.22 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 123.919 0.888 . . . . 0.0 113.134 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.49 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.4 tm? -70.19 -50.64 38.08 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -174.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.554 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.1 ptm180 -64.17 -44.65 91.42 Favored 'General case' 0 N--CA 1.421 -1.891 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.12 -177.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.0 t -63.66 -30.48 71.58 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 122.966 0.507 . . . . 0.0 110.546 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -65.31 -47.22 77.35 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.49 HD11 ' O ' ' A' ' 14' ' ' LEU . 5.4 mp -65.61 -40.92 93.15 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.476 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.2 t -58.84 -46.4 91.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 124.636 1.174 . . . . 0.0 110.166 176.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -57.32 -51.91 67.49 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.326 177.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.2 mttp -62.26 -40.33 95.83 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.692 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.527 ' O ' HG23 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -51.84 -52.61 48.1 Favored 'General case' 0 CA--C 1.508 -0.667 0 C-N-CA 124.401 1.08 . . . . 0.0 108.922 176.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.425 HG11 ' HE3' ' A' ' 40' ' ' MET . 39.4 t -54.1 -51.22 48.8 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.207 0 O-C-N 124.308 1.005 . . . . 0.0 110.752 176.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -56.92 -34.57 68.08 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -176.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.37 -46.76 14.19 Favored 'General case' 0 C--O 1.195 -1.795 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.74 177.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.6 HG22 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.84 -26.49 17.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 CA-C-O 122.063 0.935 . . . . 0.0 110.95 -174.073 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.6 ' CD2' HG22 ' A' ' 26' ' ' ILE . 69.4 m-85 -124.94 91.66 49.0 Favored Pre-proline 0 C--N 1.283 -2.305 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.129 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -65.68 102.02 0.49 Allowed 'Trans proline' 0 C--O 1.247 0.943 0 C-N-CA 122.134 1.89 . . . . 0.0 111.001 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.447 ' OG1' ' HB2' ' A' ' 34' ' ' ALA . 12.7 t -77.23 136.99 64.83 Favored Pre-proline 0 N--CA 1.423 -1.792 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.227 -176.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -76.5 -27.49 7.63 Favored 'Trans proline' 0 C--O 1.244 0.783 0 C-N-CA 122.974 2.449 . . . . 0.0 112.154 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -147.52 149.19 33.42 Favored Pre-proline 0 CA--C 1.485 -1.528 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.29 -9.91 26.85 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 121.626 1.551 . . . . 0.0 111.702 177.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.24 -10.44 57.69 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.15 0.5 . . . . 0.0 111.522 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.447 ' HB2' ' OG1' ' A' ' 29' ' ' THR . . . -81.11 -6.56 58.97 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.936 0.874 . . . . 0.0 109.025 176.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.504 ' O ' ' HG2' ' A' ' 40' ' ' MET . 21.8 mt -90.85 5.55 48.03 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.366 -178.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -133.48 17.71 3.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.107 0.956 . . . . 0.0 108.926 177.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.619 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 15.3 t70 -88.54 176.69 7.04 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.974 -176.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.619 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.8 OUTLIER -71.29 -26.72 62.99 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 173.915 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.569 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 32.2 ttm180 -59.4 -36.05 75.11 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.933 -1.03 . . . . 0.0 109.391 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.504 ' HG2' ' O ' ' A' ' 35' ' ' LEU . 8.6 tpp -58.75 -37.89 77.22 Favored 'General case' 0 C--O 1.212 -0.905 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.869 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -66.76 -27.83 67.92 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 117.947 -1.501 . . . . 0.0 110.072 -178.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -75.03 -42.06 57.97 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.522 0.729 . . . . 0.0 110.208 176.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.58 HD23 ' CG ' ' A' ' 27' ' ' PHE . 28.3 mt -61.92 -53.57 53.95 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.878 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.408 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.0 p -70.22 -27.79 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.597 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.267 -178.154 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 41' ' ' GLU . . . -60.19 -47.67 84.96 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.938 0.399 . . . . 0.0 110.199 175.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.511 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -60.29 -44.7 95.16 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.889 175.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.3 -41.93 97.82 Favored 'General case' 0 C--O 1.199 -1.58 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.485 -177.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.5 mttm -64.65 -44.22 91.14 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 176.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.511 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 58.2 pttt -63.8 -40.55 96.92 Favored 'General case' 0 C--O 1.256 1.424 0 CA-C-O 121.544 0.688 . . . . 0.0 110.373 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.449 HG23 ' CZ ' ' A' ' 46' ' ' TYR . 48.7 t -70.74 -45.32 74.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 114.933 -1.031 . . . . 0.0 110.694 178.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.415 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.9 tm-20 -56.98 -46.2 82.41 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.75 -37.05 92.95 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.624 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -61.04 -52.98 62.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.012 0.434 . . . . 0.0 110.592 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.455 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -69.85 -27.75 65.1 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 179.04 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.438 ' HH ' ' HB2' ' A' ' 7' ' ' HIS . 57.9 t80 -62.83 -49.5 74.67 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 175.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -74.5 -19.51 60.34 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.7 t -79.65 -20.08 47.58 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 120.717 0.294 . . . . 0.0 110.78 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.52 161.67 13.55 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -174.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -107.86 5.6 26.6 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.47 -1.241 . . . . 0.0 110.53 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 75.5 p -164.02 159.51 20.74 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.44 ' NE ' ' HB3' ' A' ' 9' ' ' HIS . 0.2 OUTLIER -72.51 -24.07 61.1 Favored 'General case' 0 C--O 1.197 -1.677 0 C-N-CA 118.91 -1.116 . . . . 0.0 109.818 177.746 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -66.02 -44.46 84.63 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -66.3 -46.34 77.29 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.282 175.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -45.36 89.01 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 123.157 0.286 . . . . 0.0 110.54 -177.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.467 ' HH ' ' HB ' ' B' ' 145' ' ' ILE . 0.9 OUTLIER -60.07 -44.09 95.0 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 123.762 0.664 . . . . 0.0 110.566 177.027 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.4 t-80 -64.75 -50.98 64.74 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.411 HD13 ' CB ' ' A' ' 54' ' ' MET . 4.0 pp -67.3 -32.2 73.03 Favored 'General case' 0 C--O 1.252 1.198 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.218 -174.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.524 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 0.9 OUTLIER -75.95 -31.48 59.08 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 178.268 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.471 ' HB2' ' HA ' ' B' ' 149' ' ' LEU . . . -64.51 -35.28 80.45 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.798 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -72.17 -40.55 67.89 Favored 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 120.304 -0.558 . . . . 0.0 109.985 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.75 -38.87 87.5 Favored 'General case' 0 C--O 1.212 -0.894 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.667 -179.103 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.597 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -68.69 -42.94 83.39 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.291 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -57.22 -51.75 68.07 Favored 'General case' 0 C--O 1.275 2.432 0 C-N-CA 124.64 1.176 . . . . 0.0 110.793 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.9 -36.9 85.87 Favored 'General case' 0 C--O 1.21 -0.988 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.674 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.462 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.3 mp -61.36 -39.82 84.06 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 O-C-N 123.451 0.469 . . . . 0.0 110.182 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.604 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 50.2 mt-30 -64.18 -49.9 70.23 Favored 'General case' 0 CA--C 1.496 -1.1 0 O-C-N 123.636 0.585 . . . . 0.0 110.286 -177.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.459 ' HZ2' ' HB3' ' A' ' 77' ' ' LYS . 0.8 OUTLIER -73.28 -28.22 61.99 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 118.786 -1.166 . . . . 0.0 113.922 179.377 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -64.58 -47.79 77.38 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.0 pp -64.93 -38.99 92.8 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.58 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 52.4 mt-10 -58.49 -54.45 46.94 Favored 'General case' 0 CA--C 1.49 -1.332 0 O-C-N 123.992 0.807 . . . . 0.0 110.302 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 10.6 pt-20 -68.39 -39.05 81.86 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 120.312 -0.555 . . . . 0.0 112.127 -175.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.13 -34.17 77.45 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.687 -178.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 . . . . . 0 C--N 1.314 -0.97 0 CA-C-O 121.279 0.562 . . . . 0.0 110.095 177.993 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.2 mm? . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 33.5 tp -65.38 -45.87 82.35 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 122.208 -0.307 . . . . 0.0 110.379 175.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 28.7 m -66.65 -39.74 88.36 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.149 0.5 . . . . 0.0 110.332 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 30.3 m -73.19 -22.5 60.45 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.426 0.631 . . . . 0.0 111.944 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 40.1 t0 . . . . . 0 C--N 1.313 -1.004 0 CA-C-O 122.106 0.955 . . . . 0.0 108.614 174.287 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 45.3 ttp . . . . . 0 C--O 1.21 -0.986 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -35.94 -65.96 0.23 Allowed 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.0 p -66.12 -33.92 76.88 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 121.243 0.544 . . . . 0.0 112.103 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 51.2 mm -67.0 -49.59 72.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.975 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.467 ' HB ' ' HH ' ' A' ' 65' ' ' TYR . 21.2 tt -69.7 -31.19 47.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.163 -177.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -57.81 -65.31 0.66 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 20.0 p -67.2 -45.6 76.38 Favored 'General case' 0 C--O 1.247 0.96 0 CA-C-N 114.441 -1.254 . . . . 0.0 113.517 -174.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -80.44 -34.41 36.09 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 69' ' ' ALA . 9.1 tt . . . . . 0 C--N 1.313 -0.997 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -170.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.41 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 76.9 mttt . . . . . 0 N--CA 1.421 -1.89 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.01 -21.39 31.03 Favored Glycine 0 C--N 1.321 -0.252 0 CA-C-N 115.243 -0.89 . . . . 0.0 114.947 -176.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.432 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 55.7 p-90 -64.13 -14.69 56.69 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 117.365 0.583 . . . . 0.0 112.368 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -61.29 -12.88 15.21 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 176.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -81.76 -16.85 49.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.66 0.743 . . . . 0.0 109.833 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -105.32 18.69 21.86 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.825 -171.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.67 130.32 9.67 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.831 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.2 m -105.28 162.88 13.04 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 -177.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.15 -36.26 72.72 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 120.792 0.329 . . . . 0.0 110.406 177.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -58.41 -41.33 84.72 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.828 -0.623 . . . . 0.0 112.123 178.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.529 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.2 tm? -68.3 -52.06 37.89 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 -175.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.571 ' O ' HG21 ' A' ' 19' ' ' VAL . 6.4 ptm180 -63.97 -43.84 94.56 Favored 'General case' 0 N--CA 1.415 -2.2 0 CA-C-N 114.301 -1.318 . . . . 0.0 112.849 -176.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 t -66.71 -28.3 68.32 Favored 'General case' 0 N--CA 1.44 -0.962 0 N-CA-C 110.237 -0.282 . . . . 0.0 110.237 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.7 t60 -68.02 -41.98 81.35 Favored 'General case' 0 C--O 1.241 0.644 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.529 HD11 ' O ' ' A' ' 14' ' ' LEU . 5.0 mp -67.02 -40.67 87.29 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.173 -0.922 . . . . 0.0 109.704 177.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.571 HG21 ' O ' ' A' ' 15' ' ' ARG . 76.6 t -56.85 -47.9 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.049 0.94 . . . . 0.0 109.793 174.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.474 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 23.1 t-80 -54.85 -52.23 63.41 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.367 177.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.4 mttp -61.77 -39.76 92.8 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.428 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.49 ' O ' HG22 ' A' ' 26' ' ' ILE . 8.8 mt -52.37 -52.55 52.89 Favored 'General case' 0 CA--C 1.506 -0.748 0 C-N-CA 123.463 0.705 . . . . 0.0 111.0 175.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.436 HG12 ' HE1' ' A' ' 40' ' ' MET . 53.2 t -54.92 -48.7 74.51 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.373 0 O-C-N 124.0 0.812 . . . . 0.0 109.869 176.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.474 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 40.2 mt-30 -57.55 -34.65 69.38 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -175.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.15 -45.54 15.0 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 176.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.512 HG21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.6 -23.42 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 121.988 0.899 . . . . 0.0 110.439 -174.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.512 ' CD2' HG21 ' A' ' 26' ' ' ILE . 66.1 m-85 -133.2 84.62 47.22 Favored Pre-proline 0 C--N 1.284 -2.242 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.18 106.46 0.3 Allowed 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.636 2.224 . . . . 0.0 111.194 -177.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 t -83.73 137.16 41.34 Favored Pre-proline 0 N--CA 1.425 -1.709 0 CA-C-O 121.124 0.488 . . . . 0.0 111.625 -172.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -80.74 -19.93 8.21 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.787 2.325 . . . . 0.0 112.315 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -158.53 159.06 29.93 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.705 -176.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.439 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 58.6 Cg_endo -77.17 -1.46 11.63 Favored 'Trans proline' 0 N--CA 1.442 -1.504 0 C-N-CA 121.446 1.431 . . . . 0.0 113.876 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -95.34 -17.12 21.87 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.692 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.9 -16.05 63.66 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 122.189 0.995 . . . . 0.0 108.845 172.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.517 ' O ' ' HG2' ' A' ' 40' ' ' MET . 33.3 mt -87.36 1.23 53.92 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.276 -1.329 . . . . 0.0 111.374 -179.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -133.04 24.16 4.22 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-O 122.407 1.099 . . . . 0.0 108.888 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.571 ' O ' ' HB3' ' A' ' 40' ' ' MET . 25.6 t70 -82.36 170.92 14.78 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 114.053 -1.43 . . . . 0.0 108.151 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.537 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.81 -25.5 62.89 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-O 121.903 0.859 . . . . 0.0 109.743 179.115 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.528 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 21.4 ttp180 -77.4 -15.78 59.18 Favored 'General case' 0 C--O 1.251 1.139 0 C-N-CA 124.442 1.097 . . . . 0.0 110.204 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.604 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.5 tpp -59.55 -32.94 70.8 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.068 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 45' ' ' ALA . 0.5 OUTLIER -62.32 -33.55 74.91 Favored 'General case' 0 C--O 1.184 -2.349 0 C-N-CA 119.003 -1.079 . . . . 0.0 110.595 -179.771 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -70.99 -46.14 62.79 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 121.266 0.555 . . . . 0.0 109.556 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 18.7 mt -59.36 -51.09 71.4 Favored 'General case' 0 C--O 1.245 0.868 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.11 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.604 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -72.86 -28.59 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.058 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.728 -177.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -61.37 -46.42 90.25 Favored 'General case' 0 C--O 1.246 0.896 0 N-CA-C 109.794 -0.446 . . . . 0.0 109.794 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.502 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.5 t80 -59.58 -47.04 87.12 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.773 173.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.78 -41.63 95.95 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.771 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -63.02 -46.27 88.37 Favored 'General case' 0 C--O 1.216 -0.676 0 O-C-N 123.46 0.475 . . . . 0.0 111.613 176.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.502 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 17.4 pttp -64.37 -38.81 92.36 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-O 121.631 0.729 . . . . 0.0 110.885 -176.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.416 HG22 ' CZ ' ' A' ' 46' ' ' TYR . 51.7 t -72.1 -45.26 63.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.551 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -57.07 -45.33 83.36 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 177.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.02 -40.06 95.05 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.273 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -61.12 -52.93 62.82 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.173 0.511 . . . . 0.0 111.195 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.435 ' HE3' ' HB3' ' A' ' 54' ' ' MET . 0.2 OUTLIER -67.4 -30.35 70.1 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 178.475 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -63.06 -53.76 48.73 Favored 'General case' 0 C--O 1.196 -1.759 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -73.04 -20.97 60.88 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 122.048 -0.407 . . . . 0.0 111.463 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.8 t -77.67 -42.49 34.47 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.2 162.39 28.46 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -173.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -102.89 4.53 37.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.147 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.432 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 66.7 p -160.17 160.04 32.39 Favored 'General case' 0 CA--C 1.488 -1.439 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.07 -24.26 61.48 Favored 'General case' 0 C--O 1.206 -1.215 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.152 176.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -68.07 -47.81 67.27 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -61.45 -43.92 98.02 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.462 176.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -48.38 77.03 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 123.36 0.412 . . . . 0.0 110.389 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.497 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 0.3 OUTLIER -60.58 -45.93 92.11 Favored 'General case' 0 N--CA 1.433 -1.311 0 O-C-N 123.882 0.739 . . . . 0.0 110.32 177.785 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.638 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 20.4 m80 -67.41 -42.74 82.78 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -178.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 pp -71.27 -31.63 67.72 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.56 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.496 HD21 HD23 ' A' ' 18' ' ' LEU . 1.7 pp -73.83 -32.85 63.88 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 178.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.495 ' O ' HG22 ' A' ' 72' ' ' ILE . . . -64.83 -37.31 87.18 Favored 'General case' 0 C--O 1.197 -1.703 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.225 175.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.638 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 69.9 mm-40 -64.16 -43.89 93.76 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-O 121.824 0.821 . . . . 0.0 110.25 177.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.493 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -69.88 -41.05 75.28 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.4 -177.469 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.495 HG22 ' O ' ' A' ' 69' ' ' ALA . 5.8 tt -68.5 -34.66 66.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.43 0.634 . . . . 0.0 109.467 -178.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.564 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 39.1 t80 -57.49 -54.4 47.26 Favored 'General case' 0 C--O 1.261 1.682 0 C-N-CA 125.8 1.64 . . . . 0.0 109.318 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.2 ptpt -64.75 -33.84 76.93 Favored 'General case' 0 C--O 1.207 -1.157 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.376 -178.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.438 HD11 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -63.61 -38.8 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-O 120.652 0.263 . . . . 0.0 110.858 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.531 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 37.6 mt-30 -69.07 -44.36 72.73 Favored 'General case' 0 CA--C 1.501 -0.942 0 C-N-CA 120.535 -0.466 . . . . 0.0 111.294 -177.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.565 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -72.15 -28.19 63.08 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 118.42 -1.312 . . . . 0.0 112.005 177.453 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.86 -49.04 77.85 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 176.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -64.15 -42.3 96.81 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.879 -178.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.55 -45.13 95.46 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -75.39 -32.72 60.87 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.837 -0.745 . . . . 0.0 111.936 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.85 -38.26 88.4 Favored 'General case' 0 C--N 1.348 0.504 0 CA-C-O 121.01 0.433 . . . . 0.0 110.133 -178.852 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.414 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 48.3 ttp180 . . . . . 0 N--CA 1.427 -1.617 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.608 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' B' ' 118' ' ' ASP . 26.5 tp . . . . . 0 N--CA 1.434 -1.24 0 CA-C-O 120.546 0.212 . . . . 0.0 111.388 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 63.3 tp -70.45 -41.67 72.52 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 172.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.6 m -72.24 -42.58 65.51 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.954 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.8 m -62.27 -34.6 76.88 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.245 0.545 . . . . 0.0 110.489 176.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 13.8 t70 . . . . . 0 N--CA 1.471 0.575 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 23.5 ptt? . . . . . 0 N--CA 1.445 -0.679 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.445 ' HA ' ' CG2' ' B' ' 145' ' ' ILE 0.339 38.6 mt-10 -37.19 -47.16 0.76 Allowed 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -168.012 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.6 m -64.26 -52.42 58.78 Favored 'General case' 0 C--O 1.267 1.991 0 CA-C-O 121.705 0.764 . . . . 0.0 110.169 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 46.3 mm -64.53 -51.54 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.098 -176.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.497 ' HA ' ' OH ' ' A' ' 65' ' ' TYR . 10.7 tt -58.76 -43.74 88.63 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.688 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.747 -177.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -61.59 -45.7 93.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.264 0.078 . . . . 0.0 110.852 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 20.8 p -66.54 -32.24 73.47 Favored 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -80.73 -31.36 36.06 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.283 0.563 . . . . 0.0 110.308 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 12.8 tp . . . . . 0 C--N 1.311 -1.106 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.673 -175.944 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.491 ' HD3' ' NE1' ' A' ' 6' ' ' TRP . 14.3 ptpt . . . . . 0 N--CA 1.416 -2.171 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.94 -25.9 32.26 Favored Glycine 0 C--O 1.239 0.439 0 CA-C-N 114.783 -1.099 . . . . 0.0 115.11 -172.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.491 ' NE1' ' HD3' ' A' ' 4' ' ' LYS . 67.3 p-90 -66.72 -4.66 9.48 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -64.47 -21.44 66.66 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.07 0.462 . . . . 0.0 111.081 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -89.33 0.14 57.03 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.776 0.798 . . . . 0.0 110.065 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 -106.4 6.53 30.46 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.388 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.411 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.3 p -136.02 111.08 11.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 CA-C-N 115.312 -0.858 . . . . 0.0 108.955 -178.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 m -81.72 152.85 26.84 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.834 -175.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.96 70.58 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.309 177.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -63.57 -33.88 76.57 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.521 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.0 tm? -70.6 -52.25 22.72 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -176.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.555 ' O ' HG22 ' A' ' 19' ' ' VAL . 7.0 ptm180 -65.03 -42.73 94.09 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.843 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.7 t -63.99 -31.26 72.38 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 178.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.517 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 31.0 t60 -69.66 -40.19 76.59 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.204 0.526 . . . . 0.0 109.714 178.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.521 HD13 ' O ' ' A' ' 14' ' ' LEU . 5.5 mp -65.57 -41.34 93.04 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.997 176.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 15' ' ' ARG . 69.8 t -57.13 -49.04 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 123.822 0.849 . . . . 0.0 109.628 174.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -52.28 -52.4 52.98 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.869 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.517 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 58.0 mttm -63.79 -41.06 98.0 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.805 178.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.55 ' O ' HG22 ' A' ' 26' ' ' ILE . 15.1 mt -50.7 -51.94 44.91 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 123.966 0.791 . . . . 0.0 109.949 176.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.42 HG11 ' HE2' ' A' ' 40' ' ' MET . 72.5 t -56.89 -51.04 73.12 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.697 0 O-C-N 124.206 0.941 . . . . 0.0 111.423 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -54.02 -37.64 64.3 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.445 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -82.17 -46.65 13.5 Favored 'General case' 0 C--O 1.21 -0.997 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 177.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.55 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -75.51 -22.21 16.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.66 0 CA-C-O 122.051 0.929 . . . . 0.0 110.102 -174.345 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.572 ' CG ' HD23 ' A' ' 43' ' ' LEU . 58.4 m-85 -130.58 84.1 60.08 Favored Pre-proline 0 C--N 1.275 -2.652 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.631 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -59.25 107.01 0.33 Allowed 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.865 1.71 . . . . 0.0 109.874 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.2 t -84.42 149.08 54.1 Favored Pre-proline 0 C--N 1.29 -1.993 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.055 -174.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.56 -28.61 14.19 Favored 'Trans proline' 0 C--O 1.243 0.737 0 C-N-CA 122.404 2.069 . . . . 0.0 111.427 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -155.7 161.06 30.27 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.243 -177.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.419 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 57.0 Cg_endo -78.72 -3.5 13.33 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 121.931 1.754 . . . . 0.0 114.623 -177.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 36' ' ' LYS . . . -96.89 -16.97 20.45 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.245 0.545 . . . . 0.0 109.868 177.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.614 ' HA ' ' OD2' ' A' ' 37' ' ' ASP . . . -66.06 -17.02 64.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 122.466 1.127 . . . . 0.0 108.828 173.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.419 ' CD1' ' HA ' ' A' ' 32' ' ' PRO . 55.8 mt -80.81 5.42 16.02 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 113.458 -1.701 . . . . 0.0 111.056 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.524 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 15.6 ptpt -133.82 6.19 3.69 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.179 0.514 . . . . 0.0 110.722 173.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.614 ' OD2' ' HA ' ' A' ' 34' ' ' ALA . 69.6 m-20 -85.25 179.71 7.16 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.826 178.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.447 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.4 OUTLIER -59.18 -24.83 63.41 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.307 0.643 . . . . 0.0 111.836 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.621 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 22.6 tpp180 -65.27 -35.65 81.69 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.836 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.1 tpp -59.59 -35.07 73.59 Favored 'General case' 0 C--O 1.191 -1.986 0 CA-C-N 114.715 -1.129 . . . . 0.0 112.693 -177.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.502 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 13.9 pt-20 -60.92 -32.92 72.39 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.475 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -78.57 -43.89 25.48 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.18 0.514 . . . . 0.0 110.133 178.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 16.5 mt -60.77 -50.95 71.4 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.583 -178.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.836 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.5 p -68.84 -32.95 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.59 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.049 -179.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.502 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -57.13 -46.42 82.68 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-O 120.759 0.314 . . . . 0.0 110.552 177.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.543 ' CZ ' HG22 ' A' ' 50' ' ' VAL . 3.8 t80 -61.67 -46.75 88.4 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.044 174.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.73 -37.84 88.16 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 120.319 -0.553 . . . . 0.0 111.543 -176.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 91.8 mttt -66.74 -43.1 85.09 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 123.232 0.613 . . . . 0.0 111.501 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.9 pttp -67.27 -37.29 83.2 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.543 HG22 ' CZ ' ' A' ' 46' ' ' TYR . 37.3 t -71.26 -48.0 56.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.603 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.3 tm-20 -57.55 -48.25 79.81 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 123.428 0.691 . . . . 0.0 109.584 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.41 -35.17 91.31 Favored Glycine 0 C--N 1.332 0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.308 178.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -63.52 -52.51 60.89 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 122.729 0.412 . . . . 0.0 110.273 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.409 ' HG2' ' O ' ' A' ' 50' ' ' VAL . 0.0 OUTLIER -67.86 -30.61 70.03 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 177.883 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -62.6 -41.48 99.0 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 175.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -78.81 -21.84 47.11 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.862 178.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.5 t -84.48 -29.46 26.01 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-O 121.164 0.507 . . . . 0.0 110.869 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.95 166.67 13.77 Favored 'General case' 0 C--O 1.245 0.84 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -176.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -116.72 6.93 13.35 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.416 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.6 p -157.99 158.34 34.71 Favored 'General case' 0 CA--C 1.475 -1.918 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 173.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.411 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.4 -26.21 61.79 Favored 'General case' 0 C--O 1.2 -1.522 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.926 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -66.18 -45.08 82.13 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -62.14 -46.78 87.49 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.15 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.28 -47.4 76.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.816 -0.175 . . . . 0.0 110.928 -177.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -58.96 -46.09 88.9 Favored 'General case' 0 C--O 1.208 -1.11 0 C-N-CA 123.459 0.704 . . . . 0.0 110.091 176.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -64.28 -49.61 71.15 Favored 'General case' 0 C--O 1.213 -0.84 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 pp -68.09 -32.51 72.87 Favored 'General case' 0 C--O 1.255 1.395 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.609 -176.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.506 HD21 HD21 ' A' ' 18' ' ' LEU . 1.1 pp -74.47 -35.05 63.27 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.485 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -62.8 -37.46 86.79 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.535 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -64.3 -44.51 91.4 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.954 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.411 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -68.4 -42.23 79.33 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.859 -178.575 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.509 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 7.0 tt -63.49 -44.14 98.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.564 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.44 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 35.7 t80 -55.3 -54.19 46.69 Favored 'General case' 0 C--O 1.259 1.582 0 C-N-CA 124.97 1.308 . . . . 0.0 110.035 -179.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -65.12 -32.02 73.51 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.597 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -67.77 -40.94 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 122.96 0.504 . . . . 0.0 111.189 178.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.509 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 43.2 mt-30 -66.21 -39.56 89.71 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.379 0.609 . . . . 0.0 109.425 -179.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.653 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS 0.267 0.0 OUTLIER -71.86 -27.21 62.72 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 174.134 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.481 ' OE1' HD23 ' B' ' 114' ' ' LEU . 2.2 tm-20 -64.9 -52.21 57.71 Favored 'General case' 0 C--N 1.309 -1.196 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.463 ' HA ' ' CG ' ' A' ' 82' ' ' LYS . 4.7 pp -62.16 -37.03 83.64 Favored 'General case' 0 C--O 1.248 1.015 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.142 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.506 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 12.9 pt-20 -65.93 -44.89 83.76 Favored 'General case' 0 N--CA 1.439 -1.0 0 C-N-CA 119.791 -0.763 . . . . 0.0 110.606 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -70.61 -43.34 69.5 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.54 -177.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.463 ' CG ' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -62.19 -46.35 89.31 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -177.255 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 25.5 ttm180 . . . . . 0 N--CA 1.429 -1.5 0 O-C-N 123.359 0.412 . . . . 0.0 110.594 -177.799 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.481 HD23 ' OE1' ' A' ' 78' ' ' GLU . 26.6 tp . . . . . 0 C--O 1.183 -2.433 0 CA-C-O 119.345 -0.36 . . . . 0.0 111.563 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 35.8 tp -70.96 -36.05 72.41 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-N 118.926 0.785 . . . . 0.0 109.995 175.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 31.5 m -64.93 -36.13 83.4 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 16.1 m -76.66 -36.3 57.42 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.972 176.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.5 t70 . . . . . 0 C--N 1.315 -0.911 0 C-N-CA 125.327 1.451 . . . . 0.0 110.491 179.97 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 24.4 ptp . . . . . 0 C--O 1.197 -1.661 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -17.98 -70.28 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 127.524 2.33 . . . . 0.0 115.84 -172.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 50.1 m -72.94 -38.66 66.73 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 120.94 0.4 . . . . 0.0 111.373 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 78.9 mt -65.97 -53.4 38.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.196 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 19.8 tt -65.55 -31.69 54.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.139 -177.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -59.93 -51.22 70.62 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.8 p -69.41 -39.33 77.99 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -80.95 -52.91 6.92 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.485 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 7.3 tt . . . . . 0 C--N 1.303 -1.437 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.869 -171.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.588 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 15.6 ptpt . . . . . 0 N--CA 1.422 -1.85 0 CA-C-O 121.98 0.895 . . . . 0.0 111.883 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.19 -2.97 10.24 Favored Glycine 0 CA--C 1.508 -0.355 0 CA-C-N 114.197 -1.365 . . . . 0.0 114.907 -175.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.588 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 63.7 p-90 -68.35 -11.83 60.17 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 117.391 0.595 . . . . 0.0 110.771 176.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -60.75 -25.15 66.28 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.237 0.541 . . . . 0.0 110.345 176.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -77.69 -4.51 46.49 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 121.141 0.496 . . . . 0.0 110.64 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.7 m-70 -111.61 10.6 21.15 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 121.167 0.508 . . . . 0.0 110.664 -177.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.7 p -138.71 110.39 5.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 CA-C-O 122.043 0.925 . . . . 0.0 109.261 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.9 m -81.3 156.23 25.63 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.031 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -37.96 55.09 Favored 'General case' 0 C--O 1.204 -1.338 0 C-N-CA 124.23 1.012 . . . . 0.0 110.509 176.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -60.54 -38.42 84.43 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.526 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -69.87 -50.0 46.8 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 -176.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.577 ' O ' HG21 ' A' ' 19' ' ' VAL . 0.9 OUTLIER -65.23 -46.39 80.81 Favored 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 114.362 -1.29 . . . . 0.0 112.888 -177.894 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.8 t -66.4 -26.7 67.37 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.015 0.436 . . . . 0.0 110.03 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 10.2 t60 -64.8 -49.81 69.23 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 176.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.526 HD13 ' O ' ' A' ' 14' ' ' LEU . 4.5 mp -63.7 -39.46 94.37 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.197 177.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.577 HG21 ' O ' ' A' ' 15' ' ' ARG . 65.8 t -58.35 -51.85 66.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 124.077 0.951 . . . . 0.0 110.897 175.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -54.28 -45.42 72.47 Favored 'General case' 0 C--O 1.254 1.303 0 C-N-CA 123.705 0.802 . . . . 0.0 110.482 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -66.78 -39.56 87.85 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.901 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.499 ' O ' HG23 ' A' ' 26' ' ' ILE . 30.1 mt -51.14 -50.58 58.62 Favored 'General case' 0 CA--C 1.5 -0.977 0 O-C-N 123.76 0.663 . . . . 0.0 109.963 175.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.424 HG12 ' HE1' ' A' ' 40' ' ' MET . 73.8 t -54.19 -53.47 28.79 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.89 0 O-C-N 124.285 0.99 . . . . 0.0 110.353 176.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -51.91 -37.41 52.41 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -178.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.16 -46.31 13.95 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 178.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.499 HG23 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -75.92 -21.97 15.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.856 0.836 . . . . 0.0 110.422 -174.256 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.464 ' CG ' HD21 ' A' ' 43' ' ' LEU . 42.2 m-85 -133.98 89.72 28.51 Favored Pre-proline 0 N--CA 1.412 -2.333 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.412 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -59.76 100.47 0.14 Allowed 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.019 1.813 . . . . 0.0 110.383 176.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -67.84 138.04 92.79 Favored Pre-proline 0 N--CA 1.428 -1.545 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.762 -172.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.34 -30.38 63.29 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.825 2.35 . . . . 0.0 111.832 178.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -161.79 150.03 12.46 Favored Pre-proline 0 CA--C 1.503 -0.838 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 -176.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.406 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 7.6 Cg_endo -54.73 -25.05 40.44 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 122.579 2.186 . . . . 0.0 113.717 174.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.96 -11.72 59.84 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 121.21 -0.931 . . . . 0.0 112.029 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.69 -9.38 59.8 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.761 0.791 . . . . 0.0 109.258 177.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.414 ' O ' ' HG2' ' A' ' 40' ' ' MET . 22.6 mt -87.84 -0.07 56.48 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.711 -178.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.515 ' HB3' ' HZ1' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -133.86 15.3 3.94 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.967 0.889 . . . . 0.0 110.205 178.027 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.637 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 30.9 t70 -94.25 179.73 5.21 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.16 -178.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.637 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.7 -25.15 62.83 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 120.591 0.234 . . . . 0.0 110.75 177.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.623 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 15.4 tpp180 -57.87 -34.65 69.98 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 174.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.74 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.7 tpp -60.38 -36.98 79.35 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-N 114.613 -1.176 . . . . 0.0 113.133 -178.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.8 pt-20 -62.65 -31.43 72.3 Favored 'General case' 0 C--O 1.202 -1.431 0 C-N-CA 118.528 -1.269 . . . . 0.0 110.165 -177.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.405 HD21 HD23 ' A' ' 43' ' ' LEU . 6.3 t30 -74.23 -47.42 35.35 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-O 121.77 0.795 . . . . 0.0 110.099 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 20.4 mt -63.54 -46.46 85.89 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.704 -177.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.74 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.2 p -71.86 -27.86 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.534 -178.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.436 ' HB1' ' O ' ' A' ' 41' ' ' GLU . . . -58.9 -47.6 84.41 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.512 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.9 t80 -60.09 -46.26 90.18 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.23 173.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.15 97.83 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.367 -176.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -65.09 -39.36 93.07 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 123.603 0.761 . . . . 0.0 111.629 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.7 pttp -70.96 -38.54 72.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.527 0.68 . . . . 0.0 109.923 -177.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.475 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 42.8 t -73.66 -43.2 54.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.915 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 tm-20 -59.44 -45.3 91.98 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.88 -41.37 94.14 Favored Glycine 0 C--O 1.221 -0.696 0 O-C-N 123.663 0.602 . . . . 0.0 112.281 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.9 -54.34 48.06 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.104 0.562 . . . . 0.0 111.195 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -67.24 -34.13 76.81 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -62.37 -43.37 98.98 Favored 'General case' 0 C--O 1.2 -1.521 0 C-N-CA 123.754 0.822 . . . . 0.0 109.083 176.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -81.6 -15.29 55.17 Favored 'General case' 0 C--N 1.311 -1.076 0 O-C-N 121.414 -0.804 . . . . 0.0 112.035 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.5 t -85.43 -44.37 12.8 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 122.264 -0.273 . . . . 0.0 111.716 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.94 163.63 24.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 -175.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -105.59 -2.42 23.52 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.686 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.2 m -153.5 157.71 40.23 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.8 -34.75 69.62 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 119.885 -0.726 . . . . 0.0 111.113 177.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -62.06 -39.28 91.86 Favored 'General case' 0 C--O 1.205 -1.245 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -65.35 -48.48 72.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.535 177.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -44.96 92.35 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 123.434 0.459 . . . . 0.0 110.197 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -60.53 -44.76 95.72 Favored 'General case' 0 C--O 1.208 -1.088 0 O-C-N 123.829 0.706 . . . . 0.0 110.249 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -58.8 -55.78 30.64 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.326 0.65 . . . . 0.0 111.03 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.4 -33.72 75.76 Favored 'General case' 0 C--O 1.249 1.061 0 CA-C-O 121.058 0.456 . . . . 0.0 112.096 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.514 HD21 HD21 ' A' ' 18' ' ' LEU . 1.1 pp -74.98 -32.39 61.67 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.427 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -63.44 -39.54 94.75 Favored 'General case' 0 C--O 1.21 -1.001 0 CA-C-N 115.296 -0.866 . . . . 0.0 109.573 176.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -63.43 -46.22 87.32 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.903 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.491 ' O ' HD12 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.01 -40.75 78.51 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.746 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.483 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -65.13 -44.83 95.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.285 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.429 ' CE1' ' HE2' ' A' ' 77' ' ' LYS . 41.8 t80 -56.54 -49.59 74.35 Favored 'General case' 0 C--O 1.264 1.817 0 C-N-CA 124.823 1.249 . . . . 0.0 110.876 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.422 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.4 ptpt -66.76 -33.25 75.21 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.898 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.491 HD12 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -64.29 -39.58 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 176.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 34.0 mt-30 -63.15 -46.03 89.12 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.294 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.586 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -68.83 -31.04 69.74 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 118.901 -1.12 . . . . 0.0 113.507 177.995 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.5 tp10 -61.2 -52.33 65.26 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.485 HD13 ' N ' ' A' ' 80' ' ' GLU . 4.6 pp -61.46 -43.59 98.6 Favored 'General case' 0 C--O 1.243 0.734 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -177.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.485 ' N ' HD13 ' A' ' 79' ' ' LEU . 11.4 pt-20 -69.7 -44.03 71.22 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 119.697 -0.801 . . . . 0.0 112.358 -177.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.586 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -73.47 -32.91 64.58 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.504 -178.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.594 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -66.49 -40.54 89.33 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.22 179.214 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.594 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 19.9 tpp180 . . . . . 0 N--CA 1.438 -1.029 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.912 -178.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 42.9 tp . . . . . 0 N--CA 1.437 -1.114 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.8 tp -66.43 -41.39 89.28 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 172.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 28.7 m -58.96 -41.93 88.69 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.2 m -66.66 -41.11 88.69 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-O 121.301 0.572 . . . . 0.0 111.154 175.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 15.9 t70 . . . . . 0 N--CA 1.477 0.896 0 C-N-CA 124.26 1.024 . . . . 0.0 110.347 178.246 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 24.4 ptm . . . . . 0 C--O 1.201 -1.477 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -37.89 -54.9 1.25 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 117.405 2.372 . . . . 0.0 117.405 -175.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 16.2 t -71.26 -30.81 66.75 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 119.749 -0.781 . . . . 0.0 110.317 -177.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 49.1 mm -74.82 -44.5 45.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.708 -179.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 18.5 tt -69.11 -31.32 49.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 CA-C-O 120.754 0.312 . . . . 0.0 110.248 -179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 4.0 tpp180 -63.4 -61.51 2.3 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 40.3 t -55.01 -53.76 51.66 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.575 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -81.93 -46.1 14.5 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -172.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.427 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 10.4 tt . . . . . 0 C--N 1.301 -1.538 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -169.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.449 ' HD3' ' NE1' ' A' ' 6' ' ' TRP . 13.4 ptpt . . . . . 0 N--CA 1.423 -1.819 0 CA-C-O 121.81 0.814 . . . . 0.0 113.022 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.45 -14.59 28.18 Favored Glycine 0 C--O 1.238 0.367 0 CA-C-N 113.762 -1.563 . . . . 0.0 115.079 -175.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.533 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 69.4 p-90 -73.69 -3.01 25.65 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 122.242 -0.564 . . . . 0.0 111.992 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -62.91 -24.0 67.63 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 121.153 0.502 . . . . 0.0 110.971 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -79.19 -20.75 47.61 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.572 0.701 . . . . 0.0 109.786 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.533 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 13.4 m-70 -90.29 2.84 55.07 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.649 -1.159 . . . . 0.0 110.116 -174.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.458 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.4 p -132.64 123.86 50.09 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.774 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 m -87.81 154.4 20.57 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.874 -175.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.5 -43.25 75.47 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 172.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -62.08 -32.59 73.15 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.499 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.483 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.4 tm? -73.24 -52.15 15.07 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 -177.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.548 ' O ' HG21 ' A' ' 19' ' ' VAL . 5.4 ptm180 -63.79 -42.74 97.67 Favored 'General case' 0 N--CA 1.425 -1.698 0 CA-C-N 114.618 -1.174 . . . . 0.0 112.844 -178.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.1 t -65.66 -33.53 76.1 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.242 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -64.24 -44.41 91.91 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.499 HD21 HD22 ' A' ' 68' ' ' LEU . 4.8 mp -64.82 -39.45 93.61 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.235 178.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.548 HG21 ' O ' ' A' ' 15' ' ' ARG . 65.1 t -58.32 -51.04 76.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.512 0.725 . . . . 0.0 110.01 174.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.421 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 16.4 t-80 -51.98 -47.27 64.92 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 124.23 1.012 . . . . 0.0 110.503 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.475 ' HD3' ' CD2' ' B' ' 149' ' ' LEU . 40.3 mttm -68.71 -41.14 79.52 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.593 178.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.482 ' O ' HG22 ' A' ' 26' ' ' ILE . 31.6 mt -51.32 -50.27 59.73 Favored 'General case' 0 CA--C 1.501 -0.923 0 O-C-N 123.931 0.769 . . . . 0.0 109.743 175.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.2 t -53.69 -53.78 23.74 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.577 0 O-C-N 124.549 1.155 . . . . 0.0 110.199 175.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 97.9 mt-30 -51.14 -39.38 56.14 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -177.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.71 -46.35 14.4 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.487 HG21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.03 -23.8 17.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.881 0.848 . . . . 0.0 109.674 -174.637 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.523 ' CG ' HD21 ' A' ' 43' ' ' LEU . 50.6 m-85 -136.65 87.99 20.01 Favored Pre-proline 0 N--CA 1.408 -2.558 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.014 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -55.56 113.36 1.39 Allowed 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 121.583 1.522 . . . . 0.0 109.426 174.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -77.1 137.23 65.31 Favored Pre-proline 0 N--CA 1.42 -1.971 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.725 -176.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.43 -25.72 15.01 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.937 2.424 . . . . 0.0 111.814 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -151.97 144.41 16.74 Favored Pre-proline 0 CA--C 1.497 -1.087 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -177.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -60.25 -22.96 72.59 Favored 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.115 1.876 . . . . 0.0 113.131 175.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.55 -3.26 57.51 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 121.348 -0.845 . . . . 0.0 111.095 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.418 ' HA ' ' HB2' ' A' ' 37' ' ' ASP . . . -80.15 -9.94 59.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 173.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.447 ' HA ' ' CE ' ' A' ' 40' ' ' MET . 20.2 mt -88.44 6.75 36.09 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.611 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -136.06 12.28 3.34 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-O 121.937 0.875 . . . . 0.0 109.159 173.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.675 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 23.1 t70 -91.83 -179.82 5.42 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 114.416 -1.265 . . . . 0.0 110.614 -170.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.675 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.66 -26.86 62.71 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-O 121.02 0.438 . . . . 0.0 110.526 175.608 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.656 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -66.23 -30.07 70.44 Favored 'General case' 0 C--O 1.247 0.932 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 174.696 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.574 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.98 -40.85 90.51 Favored 'General case' 0 C--O 1.193 -1.884 0 CA-C-O 118.476 -0.773 . . . . 0.0 110.976 -179.004 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.2 pt-20 -61.49 -31.8 71.8 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.507 -174.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.423 HD21 HD23 ' A' ' 43' ' ' LEU . 5.5 t30 -75.68 -43.23 48.38 Favored 'General case' 0 C--O 1.262 1.76 0 CA-C-O 121.479 0.656 . . . . 0.0 110.57 176.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.656 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 17.9 mt -64.14 -47.29 80.52 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.261 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.574 HG22 ' O ' ' A' ' 40' ' ' MET . 27.7 m -69.37 -30.63 46.43 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.05 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.082 178.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.26 -50.42 69.54 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 175.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.1 t80 -59.68 -48.37 81.95 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.444 174.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.69 -38.39 87.65 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 120.552 -0.459 . . . . 0.0 112.085 -175.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 62.9 mttm -67.07 -45.81 76.2 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 123.036 0.535 . . . . 0.0 110.665 177.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -64.03 -38.14 89.98 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.485 0.66 . . . . 0.0 110.139 -177.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.482 HG22 ' CZ ' ' A' ' 46' ' ' TYR . 50.0 t -73.1 -44.07 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.836 179.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -58.3 -45.63 87.62 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 177.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.76 -42.24 97.92 Favored Glycine 0 CA--C 1.503 -0.714 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.153 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.439 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 27.0 t70 -55.06 -54.37 43.93 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 123.026 0.53 . . . . 0.0 111.26 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.438 ' HB2' HD12 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -70.39 -30.35 67.23 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -179.611 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -62.32 -48.51 79.52 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 176.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -73.74 -24.24 59.87 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.519 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -75.03 -31.93 61.45 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-O 121.417 0.627 . . . . 0.0 110.037 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.56 167.09 12.83 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 121.683 0.754 . . . . 0.0 112.977 -175.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -118.5 11.35 12.9 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.97 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.3 p -164.76 156.22 15.27 Favored 'General case' 0 N--CA 1.421 -1.917 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.458 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.14 -28.16 63.08 Favored 'General case' 0 C--O 1.202 -1.404 0 C-N-CA 119.447 -0.901 . . . . 0.0 111.065 179.756 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -61.34 -47.79 84.26 Favored 'General case' 0 C--O 1.211 -0.925 0 O-C-N 123.66 0.6 . . . . 0.0 109.581 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.453 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 5.1 tp10 -60.93 -48.97 79.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.257 177.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -46.41 81.99 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.031 -175.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -62.66 -41.23 98.95 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 123.542 0.526 . . . . 0.0 109.742 176.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 -60.05 -57.54 12.39 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.131 0.572 . . . . 0.0 112.244 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.482 HD11 ' N ' ' A' ' 68' ' ' LEU . 3.6 pp -66.57 -32.08 73.19 Favored 'General case' 0 C--O 1.252 1.206 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -174.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.499 HD22 HD21 ' A' ' 18' ' ' LEU . 1.0 OUTLIER -75.86 -31.42 59.27 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.44 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.437 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -65.2 -34.39 78.26 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.77 175.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -68.82 -44.36 73.66 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.393 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.1 -39.08 86.65 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.174 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.45 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 7.2 tt -66.54 -44.3 90.25 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.47 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.224 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.448 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 54.4 t80 -55.36 -51.64 66.14 Favored 'General case' 0 C--O 1.255 1.386 0 C-N-CA 124.741 1.217 . . . . 0.0 111.022 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.87 -34.64 78.88 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.676 -178.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.15 -38.53 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.897 178.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.51 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 33.4 mt-30 -66.69 -41.57 87.84 Favored 'General case' 0 CA--C 1.509 -0.611 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.075 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.6 OUTLIER -71.7 -28.27 63.59 Favored 'General case' 0 N--CA 1.424 -1.741 0 C-N-CA 118.936 -1.106 . . . . 0.0 113.541 176.199 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -66.57 -42.3 87.26 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.558 ' O ' ' HB2' ' A' ' 83' ' ' ARG . 4.6 pp -65.83 -46.09 79.83 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.957 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 16.9 pt-20 -68.93 -35.36 76.71 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 119.246 -0.981 . . . . 0.0 111.904 -177.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.9 pt-20 -68.53 -42.08 78.98 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 120.039 -0.665 . . . . 0.0 111.168 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.628 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -70.02 -33.66 72.28 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.494 0.664 . . . . 0.0 110.761 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.628 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 26.5 ttt180 . . . . . 0 N--CA 1.428 -1.536 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.945 -172.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 26.3 tp . . . . . 0 N--CA 1.437 -1.104 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.552 HD23 ' NZ ' ' A' ' 82' ' ' LYS . 2.9 tm? -67.43 -35.93 80.22 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 172.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 47.0 m -62.7 -37.43 86.44 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 177.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' SER . . . . . 0.47 ' HB3' ' HA ' ' A' ' 27' ' ' PHE . 13.3 m -66.58 -49.54 66.05 Favored 'General case' 0 CA--C 1.557 1.219 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.509 173.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.2 t0 . . . . . 0 N--CA 1.487 1.408 0 C-N-CA 124.251 1.021 . . . . 0.0 111.149 179.322 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.459 ' HB3' ' HB ' ' B' ' 145' ' ' ILE . 63.6 mtm . . . . . 0 C--O 1.205 -1.267 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 8.57 -73.63 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 127.651 2.381 . . . . 0.0 117.147 -174.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 7.0 p -70.56 -44.76 66.77 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-O 121.544 0.688 . . . . 0.0 111.618 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 69.7 mt -62.32 -53.63 44.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.228 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.459 ' HB ' ' HB3' ' B' ' 141' ' ' MET . 16.2 tt -64.66 -31.3 53.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.822 -176.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -63.36 -54.44 36.92 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 39.0 t -67.09 -41.75 85.8 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.222 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -79.55 -53.91 6.41 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -174.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.475 ' CD2' ' HD3' ' A' ' 21' ' ' LYS . 10.2 tt . . . . . 0 C--N 1.303 -1.415 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt . . . . . 0 N--CA 1.424 -1.748 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.46 -14.35 8.99 Favored Glycine 0 N--CA 1.475 1.282 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 -170.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.2 p-90 -73.02 -11.69 60.65 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 117.535 0.667 . . . . 0.0 111.835 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.45 -18.39 50.98 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 121.248 0.547 . . . . 0.0 111.691 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -75.73 -21.73 57.23 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.301 0.572 . . . . 0.0 110.448 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -101.92 14.29 32.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.353 0.597 . . . . 0.0 111.631 -174.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.419 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 4.1 p -135.11 110.63 12.54 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.229 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.12 165.72 12.1 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.151 -0.931 . . . . 0.0 113.337 -176.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -36.13 76.21 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.669 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -71.8 -33.21 68.37 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.03 -0.668 . . . . 0.0 111.888 -176.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.53 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -66.81 -50.52 62.37 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.535 ' O ' HG21 ' A' ' 19' ' ' VAL . 5.3 ptm180 -67.92 -42.91 80.35 Favored 'General case' 0 N--CA 1.413 -2.279 0 CA-C-N 114.291 -1.322 . . . . 0.0 112.433 -177.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.1 t -63.96 -26.99 68.83 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.197 0.523 . . . . 0.0 110.277 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.497 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 8.5 t60 -65.62 -52.63 50.48 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 175.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.53 HD13 ' O ' ' A' ' 14' ' ' LEU . 4.4 mp -61.39 -42.66 99.08 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.356 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.535 HG21 ' O ' ' A' ' 15' ' ' ARG . 51.5 t -55.92 -50.32 69.74 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 C-N-CA 124.442 1.097 . . . . 0.0 110.487 175.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -55.33 -42.63 74.06 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 123.833 0.853 . . . . 0.0 110.477 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 46.6 mttm -69.58 -36.54 76.35 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.317 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.426 ' O ' HG22 ' A' ' 26' ' ' ILE . 83.5 mt -57.01 -42.1 79.7 Favored 'General case' 0 CA--C 1.518 -0.268 0 O-C-N 123.286 0.366 . . . . 0.0 110.022 175.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.416 ' HA ' HG22 ' A' ' 26' ' ' ILE . 55.7 t -56.88 -52.84 50.12 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.148 0 O-C-N 124.22 0.95 . . . . 0.0 110.533 171.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -54.65 -33.54 60.8 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.0 -43.95 18.84 Favored 'General case' 0 C--O 1.206 -1.195 0 CA-C-O 121.16 0.505 . . . . 0.0 111.856 177.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.426 HG22 ' O ' ' A' ' 22' ' ' LEU . 2.6 tt -73.72 -31.42 31.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 O-C-N 120.952 -1.092 . . . . 0.0 110.885 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -132.07 95.44 21.86 Favored Pre-proline 0 C--N 1.264 -3.144 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.176 -176.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -63.89 94.14 0.19 Allowed 'Trans proline' 0 C--N 1.358 1.034 0 C-N-CA 122.219 1.946 . . . . 0.0 110.556 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.405 ' OG1' ' HB2' ' A' ' 34' ' ' ALA . 14.6 t -62.94 132.56 95.01 Favored Pre-proline 0 N--CA 1.426 -1.649 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.383 -175.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -67.51 -33.14 29.88 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.7 2.267 . . . . 0.0 111.791 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -150.9 147.65 21.31 Favored Pre-proline 0 C--N 1.306 -1.289 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 -177.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -56.29 -17.87 22.3 Favored 'Trans proline' 0 CA--C 1.553 1.425 0 C-N-CA 122.507 2.138 . . . . 0.0 113.596 174.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.33 -6.02 59.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.696 -0.627 . . . . 0.0 112.193 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.405 ' HB2' ' OG1' ' A' ' 29' ' ' THR . . . -81.84 -11.35 58.99 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 122.138 0.971 . . . . 0.0 108.8 175.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.478 ' O ' ' HG2' ' A' ' 40' ' ' MET . 33.8 mt -84.91 4.51 33.11 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.233 -1.348 . . . . 0.0 110.472 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -133.22 17.36 4.08 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-O 121.863 0.84 . . . . 0.0 109.856 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.575 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 37.2 t70 -92.02 177.11 6.27 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.827 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.575 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.81 -26.84 63.48 Favored 'General case' 0 C--N 1.307 -1.248 0 O-C-N 122.28 -0.262 . . . . 0.0 110.409 176.478 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.582 ' O ' HD13 ' A' ' 43' ' ' LEU . 39.8 ttm180 -60.08 -35.81 76.0 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.719 0.771 . . . . 0.0 109.558 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.597 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.8 tpp -57.83 -32.27 67.44 Favored 'General case' 0 C--O 1.2 -1.509 0 CA-C-N 114.603 -1.18 . . . . 0.0 112.228 178.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 13.5 pt-20 -64.28 -32.37 73.93 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 118.551 -1.26 . . . . 0.0 110.299 -178.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -72.6 -45.28 59.84 Favored 'General case' 0 C--O 1.253 1.27 0 CA-C-O 122.277 1.037 . . . . 0.0 109.139 176.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 39' ' ' ARG . 3.0 mp -55.7 -56.33 21.76 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 113.551 -1.659 . . . . 0.0 110.165 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.597 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 2.7 p -70.28 -27.55 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.858 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.176 -176.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -57.6 -49.36 76.67 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.514 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.1 t80 -62.21 -45.55 92.85 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.083 175.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.22 -45.99 83.34 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.915 -177.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -63.88 -43.84 94.84 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 124.055 0.942 . . . . 0.0 112.857 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.514 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 59.1 pttt -64.09 -41.05 97.44 Favored 'General case' 0 C--O 1.251 1.163 0 CA-C-O 121.582 0.706 . . . . 0.0 110.175 -177.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.467 HG21 ' CE2' ' A' ' 46' ' ' TYR . 55.9 t -73.1 -45.04 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.163 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.9 tm-20 -58.06 -45.25 87.37 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 177.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.25 -43.15 93.7 Favored Glycine 0 N--CA 1.438 -1.203 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.111 178.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -58.53 -54.12 50.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.661 0.267 . . . . 0.0 111.495 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -65.77 -31.43 72.4 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -65.05 -38.74 91.83 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -82.09 -23.25 35.85 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 121.747 -0.596 . . . . 0.0 112.063 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -80.22 -40.95 26.1 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 123.047 0.539 . . . . 0.0 111.473 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.17 161.09 29.1 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -106.12 7.4 31.68 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.829 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.5 p -159.11 157.9 31.88 Favored 'General case' 0 CA--C 1.477 -1.849 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.419 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -72.48 -24.43 61.18 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.066 -1.053 . . . . 0.0 109.614 178.184 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -67.57 -47.48 69.66 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 115.088 -0.96 . . . . 0.0 108.499 177.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -60.36 -46.59 89.39 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.496 175.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -46.4 85.87 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 123.319 0.387 . . . . 0.0 110.631 -177.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -62.0 -44.67 96.24 Favored 'General case' 0 C--O 1.216 -0.707 0 O-C-N 123.643 0.59 . . . . 0.0 110.679 177.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -67.7 -43.13 80.85 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 pp -71.69 -35.18 70.17 Favored 'General case' 0 C--O 1.25 1.079 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.123 -177.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.501 HD23 HD23 ' A' ' 18' ' ' LEU . 1.3 pp -72.26 -33.68 67.67 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.47 ' HB1' ' O ' ' B' ' 148' ' ' GLU . . . -63.51 -39.63 94.93 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.03 176.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -62.15 -49.47 75.73 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.433 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -34.55 72.51 Favored 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.042 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.528 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 4.9 tt -70.88 -45.85 71.13 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.563 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -55.15 -50.75 68.48 Favored 'General case' 0 C--O 1.282 2.798 0 C-N-CA 124.665 1.186 . . . . 0.0 110.887 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -62.98 -39.5 94.91 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.629 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -62.44 -39.92 86.14 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.981 0 O-C-N 123.356 0.41 . . . . 0.0 111.861 177.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.612 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 22.1 mm-40 -57.75 -49.67 75.81 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 121.87 0.843 . . . . 0.0 109.637 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.45 -38.21 74.44 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.661 0.985 . . . . 0.0 113.661 178.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.33 -45.53 91.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 3.7 pp -64.25 -42.82 96.33 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.489 -177.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.447 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 4.7 mm-40 -68.9 -41.44 78.25 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -70.47 -35.03 73.06 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 119.464 -0.894 . . . . 0.0 111.438 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.53 -29.87 62.74 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.549 0.69 . . . . 0.0 109.788 178.009 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.526 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 4.9 tmm_? . . . . . 0 C--N 1.321 -0.632 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.01 -177.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 31.8 tp . . . . . 0 C--O 1.199 -1.562 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.19 -40.03 82.32 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 174.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 43.6 m -63.81 -39.53 94.46 Favored 'General case' 0 CA--C 1.552 1.021 0 CA-C-O 121.353 0.597 . . . . 0.0 109.402 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.1 t -68.44 -42.49 78.76 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.398 177.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 16.9 t70 . . . . . 0 N--CA 1.476 0.844 0 C-N-CA 125.898 1.679 . . . . 0.0 111.278 179.328 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.436 ' HB3' ' HB ' ' B' ' 145' ' ' ILE . 69.3 mtp . . . . . 0 N--CA 1.434 -1.26 0 CA-C-O 119.457 -0.306 . . . . 0.0 110.423 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 25.64 -84.13 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 127.853 2.461 . . . . 0.0 115.502 176.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.1 p -72.86 -47.1 48.96 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 114.55 -1.204 . . . . 0.0 111.216 -175.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 65.3 mt -63.79 -41.91 94.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.767 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.471 HG12 ' NE2' ' A' ' 17' ' ' HIS . 9.5 tp -66.19 -41.32 89.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.097 0 C-N-CA 119.617 -0.833 . . . . 0.0 110.693 -178.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -66.17 -57.08 8.4 Favored 'General case' 0 N--CA 1.436 -1.128 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.133 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 43.4 t -55.2 -53.96 49.41 Favored 'General case' 0 C--O 1.249 1.049 0 C-N-CA 123.757 0.823 . . . . 0.0 113.133 -176.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.47 ' O ' ' HB1' ' A' ' 69' ' ' ALA . 5.5 mm-40 -81.84 -42.25 19.89 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -172.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.416 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 1.5 tm? . . . . . 0 N--CA 1.454 -0.241 0 C-N-CA 120.469 -0.493 . . . . 0.0 110.358 -173.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.489 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.6 ptpt . . . . . 0 N--CA 1.427 -1.617 0 CA-C-O 121.643 0.735 . . . . 0.0 111.647 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -74.02 -0.68 57.17 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 114.589 -1.187 . . . . 0.0 113.702 -175.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.489 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 52.2 p-90 -72.67 -7.74 51.86 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 117.57 0.685 . . . . 0.0 111.584 177.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.464 ' HB2' ' HH ' ' A' ' 55' ' ' TYR . 7.4 p80 -65.99 -9.61 31.84 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 9.7 pt-20 -88.13 -8.64 55.12 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.272 0.558 . . . . 0.0 110.027 174.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -94.98 9.89 37.67 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.533 0.682 . . . . 0.0 109.867 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.416 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.6 p -141.79 155.17 19.8 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.2 m -123.69 160.59 26.88 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.62 -36.1 71.34 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 120.903 0.382 . . . . 0.0 110.226 175.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.444 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 4.0 m-20 -63.68 -33.69 76.19 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.501 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.4 tm? -73.17 -51.13 19.01 Favored 'General case' 0 CA--C 1.498 -1.055 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 -177.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.513 ' O ' HG22 ' A' ' 19' ' ' VAL . 7.0 ptm180 -64.81 -44.18 90.75 Favored 'General case' 0 N--CA 1.423 -1.802 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.976 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.8 t -66.29 -29.17 69.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 18.2 t60 -65.18 -44.69 87.64 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.501 HD11 ' O ' ' A' ' 14' ' ' LEU . 3.7 mp -66.6 -39.64 88.48 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.338 177.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 15' ' ' ARG . 55.0 t -57.45 -51.9 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.842 0.857 . . . . 0.0 110.3 175.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -55.98 -45.78 78.86 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.314 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -65.84 -40.22 91.55 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.245 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.485 ' O ' HG23 ' A' ' 26' ' ' ILE . 28.7 mt -51.26 -50.29 59.52 Favored 'General case' 0 CA--C 1.498 -1.048 0 O-C-N 123.676 0.61 . . . . 0.0 109.543 174.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.9 t -53.92 -51.69 42.92 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.497 0 O-C-N 124.468 1.105 . . . . 0.0 110.528 175.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -55.77 -35.41 66.21 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -176.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.448 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -81.44 -45.58 15.84 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 177.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.485 HG23 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -77.72 -25.49 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 122.044 0.926 . . . . 0.0 110.565 -174.682 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.553 ' CG ' HD21 ' A' ' 43' ' ' LEU . 57.6 m-85 -131.44 98.07 18.77 Favored Pre-proline 0 C--N 1.278 -2.514 0 CA-C-N 115.289 -0.869 . . . . 0.0 108.732 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -49.51 133.63 31.83 Favored 'Trans proline' 0 CA--C 1.48 -2.183 0 C-N-CA 122.394 2.063 . . . . 0.0 111.209 177.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.1 m -91.28 116.8 67.17 Favored Pre-proline 1 N--CA 1.369 -4.505 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.374 -174.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -79.92 -30.42 2.27 Favored 'Trans proline' 0 C--N 1.323 -0.78 0 C-N-CA 122.088 1.858 . . . . 0.0 111.255 176.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -147.84 147.43 27.03 Favored Pre-proline 0 CA--C 1.488 -1.431 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -69.2 -12.02 32.97 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 121.231 1.287 . . . . 0.0 110.283 172.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.32 -13.71 45.75 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.089 175.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.705 ' HA ' ' OD2' ' A' ' 37' ' ' ASP . . . -72.07 -15.17 62.01 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 122.18 0.991 . . . . 0.0 109.478 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.9 mt -85.36 7.34 22.79 Favored 'General case' 0 N--CA 1.426 -1.629 0 CA-C-N 113.592 -1.64 . . . . 0.0 109.403 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -132.89 0.44 3.5 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 118.984 -1.087 . . . . 0.0 109.914 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.705 ' OD2' ' HA ' ' A' ' 34' ' ' ALA . 48.5 m-20 -72.88 176.86 5.28 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.157 -175.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.611 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -65.35 -21.81 66.74 Favored 'General case' 0 C--O 1.203 -1.342 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 170.637 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.62 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 41.0 ttp180 -65.04 -29.52 70.43 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.19 175.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.593 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.02 -39.57 82.31 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-O 118.763 -0.636 . . . . 0.0 110.209 -179.503 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.8 pt-20 -62.81 -28.37 69.96 Favored 'General case' 0 C--O 1.205 -1.257 0 O-C-N 123.238 0.336 . . . . 0.0 110.946 -176.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.489 HD21 HD23 ' A' ' 43' ' ' LEU . 4.6 t30 -76.17 -46.18 29.78 Favored 'General case' 0 C--O 1.265 1.911 0 CA-C-O 121.696 0.76 . . . . 0.0 110.008 177.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 18.3 mt -63.81 -49.57 72.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.204 -178.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.593 HG22 ' O ' ' A' ' 40' ' ' MET . 34.0 m -68.52 -33.17 58.57 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.294 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.383 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -55.21 -46.97 75.92 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 118.325 0.511 . . . . 0.0 109.991 175.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 6.6 t80 -63.1 -48.64 77.7 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.645 174.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.35 -43.52 88.35 Favored 'General case' 0 C--O 1.201 -1.474 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.356 -176.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -66.19 -40.77 90.65 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 124.117 0.967 . . . . 0.0 111.827 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 53.2 pttt -66.71 -40.71 88.55 Favored 'General case' 0 C--O 1.251 1.151 0 CA-C-O 121.497 0.665 . . . . 0.0 109.945 -178.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 79.3 t -71.63 -49.23 47.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.605 179.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.3 tm-20 -57.93 -47.67 82.18 Favored 'General case' 0 CA--C 1.51 -0.594 0 C-N-CA 123.836 0.854 . . . . 0.0 109.17 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.77 -38.72 92.61 Favored Glycine 0 N--CA 1.428 -1.859 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.445 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -64.11 -51.78 62.34 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 111.543 0.201 . . . . 0.0 111.543 178.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.409 ' HE1' ' HB3' ' A' ' 54' ' ' MET . 0.4 OUTLIER -64.28 -32.38 73.96 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 178.025 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.464 ' HH ' ' HB2' ' A' ' 7' ' ' HIS . 71.5 t80 -64.78 -41.62 95.7 Favored 'General case' 0 C--O 1.201 -1.476 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -80.73 -16.78 53.0 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.622 -0.674 . . . . 0.0 112.097 177.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.3 t -82.78 -52.99 6.25 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 122.536 0.334 . . . . 0.0 111.433 -178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.17 161.66 13.18 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -175.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -104.73 6.28 34.04 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.316 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.0 p -162.42 156.22 20.93 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 174.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.416 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -67.76 -31.15 70.84 Favored 'General case' 0 C--O 1.201 -1.499 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.458 -178.787 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -65.21 -47.22 77.64 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.303 177.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -58.26 -45.16 88.34 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 111.417 0.155 . . . . 0.0 111.417 175.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -44.14 92.21 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.513 -178.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -62.46 -45.59 92.35 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.295 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.471 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 34.0 m170 -61.1 -53.97 50.47 Favored 'General case' 0 C--O 1.215 -0.741 0 O-C-N 123.274 0.359 . . . . 0.0 111.634 -178.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.4 pp -64.33 -36.73 85.09 Favored 'General case' 0 C--O 1.256 1.417 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -175.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.561 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -74.67 -33.86 62.57 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.475 ' HB2' ' HA ' ' B' ' 149' ' ' LEU . . . -63.46 -32.76 74.3 Favored 'General case' 0 C--O 1.205 -1.275 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.343 175.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 22.1 mt-10 -72.4 -41.37 66.36 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.276 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.561 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -65.82 -39.03 90.45 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.403 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.448 HG13 ' CB ' ' A' ' 25' ' ' ALA . 8.7 tt -68.24 -42.99 85.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.297 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.476 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 39.1 t80 -58.19 -52.48 65.38 Favored 'General case' 0 C--O 1.259 1.578 0 C-N-CA 124.427 1.091 . . . . 0.0 111.348 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.0 ptpt -64.4 -33.34 75.63 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.414 HD12 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -68.92 -37.68 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.867 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.167 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.497 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 11.5 mt-30 -66.6 -41.48 88.38 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.629 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 10.6 ptpt -75.23 -27.09 59.37 Favored 'General case' 0 N--CA 1.424 -1.763 0 C-N-CA 118.982 -1.087 . . . . 0.0 112.759 176.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.509 ' OE2' ' HG2' ' A' ' 82' ' ' LYS . 5.5 tm-20 -62.56 -48.89 77.51 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 175.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 83' ' ' ARG . 4.6 pp -63.7 -39.67 94.89 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.836 178.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -55.56 -53.6 54.4 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 123.466 0.479 . . . . 0.0 111.289 176.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -68.92 -47.03 66.78 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 120.15 -0.62 . . . . 0.0 112.418 -177.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.509 ' HG2' ' OE2' ' A' ' 78' ' ' GLU 0.254 0.0 OUTLIER -74.09 -38.73 63.79 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -176.337 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 7.6 mmm180 . . . . . 0 C--N 1.307 -1.279 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.412 HD21 ' HB3' ' A' ' 79' ' ' LEU . 52.9 tp . . . . . 0 C--O 1.201 -1.454 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.2 tp -67.83 -36.71 80.83 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.192 177.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 88.0 m -64.92 -46.73 80.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.097 176.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.5 m -64.12 -38.08 89.76 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.616 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 C--N 1.317 -0.805 0 C-N-CA 123.746 0.818 . . . . 0.0 111.851 177.332 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 24.9 ptt? . . . . . 0 C--O 1.208 -1.103 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -28.51 -61.14 0.12 Allowed 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 126.543 1.937 . . . . 0.0 116.162 -172.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 18.5 m -68.04 -35.72 78.72 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.105 0.478 . . . . 0.0 111.48 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 62.1 mt -72.16 -45.79 60.9 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.891 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.6 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 18.0 tt -68.26 -31.57 52.09 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.4 -178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 49.3 ttp180 -64.86 -54.75 26.07 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 33.1 t -59.24 -50.15 75.11 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.787 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -81.27 -42.69 20.28 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -175.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.6 ' HB3' ' O ' ' B' ' 145' ' ' ILE . 4.0 tt . . . . . 0 C--N 1.31 -1.119 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -172.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 14.6 ptpt . . . . . 0 N--CA 1.43 -1.461 0 CA-C-O 121.34 0.59 . . . . 0.0 111.669 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.2 -12.26 16.02 Favored Glycine 0 N--CA 1.465 0.612 0 N-CA-C 116.075 1.19 . . . . 0.0 116.075 -173.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.462 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 57.3 p-90 -64.06 -17.07 63.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.542 0.671 . . . . 0.0 111.035 178.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -63.33 -10.39 16.2 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.7 -30.45 59.32 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.349 0.595 . . . . 0.0 109.88 175.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -93.11 20.41 6.87 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.524 -174.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.411 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.7 p -132.98 110.19 15.1 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -75.89 153.07 36.98 Favored 'General case' 0 C--N 1.294 -1.839 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.916 -173.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -38.84 86.1 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 174.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.523 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 3.5 m-20 -56.91 -39.14 73.89 Favored 'General case' 0 C--O 1.214 -0.763 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.629 174.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.56 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.3 tm? -72.42 -52.35 16.33 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -173.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.507 ' O ' HG22 ' A' ' 19' ' ' VAL . 5.6 ptm180 -66.15 -43.37 87.21 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-N 114.944 -1.025 . . . . 0.0 113.293 -176.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.2 t -67.11 -28.66 68.34 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.523 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 14.9 t60 -65.71 -44.12 87.04 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 176.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.56 HD12 ' O ' ' A' ' 14' ' ' LEU . 4.1 mp -65.26 -41.41 94.27 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.888 176.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 15' ' ' ARG . 67.6 t -57.21 -52.42 56.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.665 0.786 . . . . 0.0 110.169 176.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.421 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 20.5 t-80 -54.93 -43.79 73.65 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.494 177.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.433 ' HD3' ' HG ' ' B' ' 149' ' ' LEU . 36.2 mttp -66.1 -37.95 87.02 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.375 177.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.2 mt -55.67 -43.08 75.99 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 175.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.452 HG13 ' HE3' ' A' ' 40' ' ' MET . 53.6 t -57.25 -52.65 53.84 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.628 0 O-C-N 124.155 0.91 . . . . 0.0 110.411 173.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -59.05 -29.15 67.09 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.71 -45.31 15.88 Favored 'General case' 0 C--O 1.207 -1.133 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.769 174.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.44 HG23 ' HA ' ' A' ' 23' ' ' VAL . 2.7 tt -69.78 -33.75 57.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-O 122.07 0.938 . . . . 0.0 110.233 -177.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -126.39 92.26 45.77 Favored Pre-proline 0 N--CA 1.4 -2.971 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -57.7 102.17 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 121.849 1.7 . . . . 0.0 107.955 171.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 t -73.92 128.27 86.88 Favored Pre-proline 0 N--CA 1.408 -2.568 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.637 -172.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -72.65 -28.83 13.66 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.417 2.078 . . . . 0.0 111.438 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -151.01 147.12 20.04 Favored Pre-proline 0 CA--C 1.498 -1.033 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -177.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -56.93 -19.66 33.03 Favored 'Trans proline' 0 CA--C 1.549 1.274 0 C-N-CA 122.359 2.039 . . . . 0.0 114.171 175.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.38 -19.97 59.24 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 121.406 -0.809 . . . . 0.0 112.005 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.68 -7.56 50.99 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.383 0.611 . . . . 0.0 110.421 178.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.494 ' O ' ' HG2' ' A' ' 40' ' ' MET . 23.6 mt -93.48 0.31 56.68 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.689 -178.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -133.72 19.77 3.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.243 0.544 . . . . 0.0 111.979 -177.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.541 ' O ' ' HB3' ' A' ' 40' ' ' MET . 38.0 t70 -92.12 176.69 6.4 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.78 ' HD2' ' N ' ' A' ' 39' ' ' ARG . 5.4 ppt_? -61.54 -26.1 67.72 Favored 'General case' 0 C--N 1.282 -2.358 0 CA-C-O 121.922 0.868 . . . . 0.0 108.934 172.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.78 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 40.6 ttm180 -63.52 -29.41 70.68 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-O 122.145 0.974 . . . . 0.0 109.109 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.715 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.7 tpp -65.13 -34.64 78.89 Favored 'General case' 0 C--O 1.192 -1.95 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.312 -178.355 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.1 pt-20 -63.64 -32.89 74.51 Favored 'General case' 0 C--O 1.189 -2.081 0 C-N-CA 119.396 -0.922 . . . . 0.0 109.445 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -68.99 -49.85 54.21 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 121.589 0.709 . . . . 0.0 110.045 176.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 67.2 mt -63.7 -48.07 78.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.6 -176.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.715 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.4 p -73.42 -27.88 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.885 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.209 -178.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -60.8 -45.56 93.94 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 177.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.495 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.1 t80 -60.73 -46.36 90.74 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.942 174.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.23 -40.17 93.01 Favored 'General case' 0 C--O 1.202 -1.443 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.956 -177.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.0 mttm -68.38 -43.72 76.73 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 123.312 0.645 . . . . 0.0 111.306 178.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.3 pttp -65.74 -38.18 88.42 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 121.118 0.485 . . . . 0.0 109.918 -177.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 41.3 t -70.76 -49.66 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.268 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.401 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -56.04 -44.67 79.0 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.49 -37.97 95.6 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.62 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -59.42 -54.25 48.81 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -34.22 76.5 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.93 -49.85 75.79 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -77.33 -17.68 58.08 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 28.3 t -87.42 -30.85 20.4 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 120.825 0.345 . . . . 0.0 110.929 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.29 159.51 23.13 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 121.246 0.546 . . . . 0.0 111.633 -177.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -108.59 8.48 27.15 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-O 121.717 0.77 . . . . 0.0 110.4 -177.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 83.1 p -160.71 160.71 31.78 Favored 'General case' 0 N--CA 1.417 -2.101 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 173.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.411 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.3 -26.76 62.08 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.047 176.677 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -65.48 -47.82 74.77 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -62.83 -46.22 88.94 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.163 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -48.09 76.09 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.845 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -61.38 -45.36 94.67 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 123.796 0.685 . . . . 0.0 110.304 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.472 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 10.7 t60 -67.95 -49.86 59.3 Favored 'General case' 0 C--O 1.203 -1.372 0 CA-C-O 119.23 -0.414 . . . . 0.0 111.752 -176.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.1 pp -64.55 -35.37 80.76 Favored 'General case' 0 C--O 1.271 2.219 0 CA-C-N 118.517 0.599 . . . . 0.0 111.662 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.486 HD22 HD21 ' A' ' 18' ' ' LEU . 1.3 pp -70.1 -38.55 75.67 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.458 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -64.75 -35.74 82.06 Favored 'General case' 0 C--O 1.2 -1.508 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.561 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 16.0 mt-10 -67.76 -43.78 79.04 Favored 'General case' 0 C--N 1.312 -1.039 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.684 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -38.93 74.76 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 118.663 -1.215 . . . . 0.0 111.732 -179.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.458 HG23 ' HA ' ' A' ' 69' ' ' ALA . 9.6 tt -65.62 -40.41 87.92 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 C-N-CA 120.564 -0.455 . . . . 0.0 110.112 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.481 ' CZ ' ' HE3' ' A' ' 77' ' ' LYS . 36.6 t80 -57.31 -54.5 46.15 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 124.682 1.193 . . . . 0.0 111.121 179.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.5 ptpt -66.44 -32.34 73.64 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.083 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.78 -36.92 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.809 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.154 177.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.554 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 19.6 mt-30 -67.44 -47.75 69.26 Favored 'General case' 0 CA--C 1.498 -1.056 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.635 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.582 ' HB3' ' HZ3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -69.45 -28.12 65.83 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.404 -0.919 . . . . 0.0 112.627 177.505 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.6 tp10 -65.16 -47.85 75.59 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -65.41 -36.07 82.82 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.533 -178.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.98 -47.29 78.08 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.351 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.37 -33.37 65.01 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 119.49 -0.884 . . . . 0.0 111.773 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -64.58 -36.17 83.37 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.794 178.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 16.2 tpp180 . . . . . 0 N--CA 1.442 -0.855 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.227 178.821 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.42 HD22 ' HB3' ' A' ' 79' ' ' LEU . 62.4 tp . . . . . 0 C--O 1.203 -1.389 0 CA-C-O 120.438 0.161 . . . . 0.0 110.618 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 60.8 tp -63.57 -38.82 92.57 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 26.4 m -65.19 -40.15 93.84 Favored 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.983 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.3 t -77.53 -25.58 50.34 Favored 'General case' 0 CA--C 1.561 1.389 0 CA-C-O 121.28 0.562 . . . . 0.0 110.204 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 12.3 t70 . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 121.951 0.882 . . . . 0.0 109.163 176.851 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 C--O 1.198 -1.632 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -22.02 -65.42 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 126.876 2.071 . . . . 0.0 116.218 -174.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.4 p -69.84 -43.92 70.97 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.256 0.551 . . . . 0.0 112.01 -176.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 45.8 mm -69.57 -40.54 79.7 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.465 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 13.2 tt -67.42 -36.78 77.47 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.863 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -55.03 -51.64 65.65 Favored 'General case' 0 C--O 1.25 1.11 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.3 m -61.48 -52.36 64.83 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-N 114.509 -1.223 . . . . 0.0 112.567 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -68.52 -47.83 65.94 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.438 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 2.5 tm? . . . . . 0 C--N 1.306 -1.286 0 CA-C-N 114.953 -1.021 . . . . 0.0 112.756 -168.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.609 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.3 ptpt . . . . . 0 N--CA 1.411 -2.38 0 CA-C-O 121.678 0.752 . . . . 0.0 112.048 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.15 -9.65 84.1 Favored Glycine 0 C--O 1.24 0.517 0 CA-C-N 115.076 -0.965 . . . . 0.0 113.273 -175.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.609 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 65.0 p-90 -68.73 -7.59 35.07 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -59.83 -26.17 65.57 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 120.977 0.418 . . . . 0.0 111.703 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -86.81 0.33 55.04 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.547 0.689 . . . . 0.0 110.677 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 -104.95 3.01 30.28 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.953 -178.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.571 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 1.5 t -119.28 128.51 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.681 0 N-CA-C 103.968 -2.604 . . . . 0.0 103.968 176.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.481 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -77.66 151.46 34.26 Favored 'General case' 0 C--N 1.275 -2.665 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -36.15 79.35 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 174.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 32.8 t70 -72.66 -27.83 62.35 Favored 'General case' 0 C--O 1.199 -1.581 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.619 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 17' ' ' HIS . 3.2 tm? -70.03 -52.95 19.92 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -177.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.5 ' O ' HG22 ' A' ' 19' ' ' VAL . 1.1 ptm180 -57.89 -48.67 79.16 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 175.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.4 m -67.89 -21.19 65.16 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.192 0.52 . . . . 0.0 111.816 -177.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.435 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 15.9 t60 -69.63 -47.24 64.11 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 175.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.49 HD22 HD23 ' A' ' 68' ' ' LEU . 1.2 mp -64.83 -40.52 95.31 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.768 177.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 15' ' ' ARG . 78.8 t -56.69 -50.38 74.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.68 0.792 . . . . 0.0 109.939 174.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 27.0 t-80 -54.86 -44.15 73.74 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.861 0.864 . . . . 0.0 109.907 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.425 ' HZ2' ' CD1' ' B' ' 145' ' ' ILE . 76.7 mttt -69.48 -36.63 76.72 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.924 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.423 ' O ' HG22 ' A' ' 26' ' ' ILE . 63.7 mt -56.38 -45.28 80.64 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 175.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.443 HG11 ' HE1' ' A' ' 40' ' ' MET . 42.1 t -54.88 -55.56 15.26 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.41 0 O-C-N 124.211 0.944 . . . . 0.0 109.907 172.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -56.63 -30.1 62.93 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -176.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.436 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -81.32 -45.14 16.62 Favored 'General case' 0 C--O 1.208 -1.081 0 O-C-N 122.18 -0.325 . . . . 0.0 111.717 175.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.423 HG22 ' O ' ' A' ' 22' ' ' LEU . 2.8 tt -70.82 -34.92 58.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 122.051 0.929 . . . . 0.0 110.304 -179.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.455 ' CD2' HD22 ' A' ' 43' ' ' LEU . 11.0 m-85 -136.99 88.01 18.35 Favored Pre-proline 0 C--N 1.267 -3.003 0 C-N-CA 124.357 1.063 . . . . 0.0 109.751 -177.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -44.76 133.03 10.47 Favored 'Trans proline' 0 CA--C 1.487 -1.864 0 C-N-CA 122.696 2.264 . . . . 0.0 112.431 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 m -90.27 117.92 68.41 Favored Pre-proline 1 N--CA 1.364 -4.737 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.746 -173.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -76.29 -32.38 4.04 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.702 2.268 . . . . 0.0 111.745 178.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -153.59 144.17 15.83 Favored Pre-proline 0 CA--C 1.489 -1.372 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 -177.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.411 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 9.4 Cg_endo -56.02 -23.25 42.71 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.68 2.253 . . . . 0.0 113.817 176.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.26 -14.18 60.88 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 121.377 -0.827 . . . . 0.0 111.719 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.29 -15.55 61.9 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.697 0.761 . . . . 0.0 109.487 176.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.497 ' O ' ' HG2' ' A' ' 40' ' ' MET . 10.4 mt -88.32 -0.87 57.63 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.043 -176.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.479 ' HB3' ' HZ1' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -133.39 16.82 4.04 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.648 0.737 . . . . 0.0 109.29 176.704 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.582 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 17.0 t70 -86.36 173.55 9.62 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.109 -176.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.582 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.67 -25.68 62.21 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.025 0.44 . . . . 0.0 110.651 174.262 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.576 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 6.4 tpt180 -62.84 -38.09 89.4 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 175.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.829 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.3 tpp -56.16 -37.18 69.19 Favored 'General case' 0 C--O 1.192 -1.932 0 CA-C-N 113.574 -1.648 . . . . 0.0 112.691 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -61.79 -32.73 73.04 Favored 'General case' 0 C--O 1.212 -0.887 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.652 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -77.21 -43.5 33.43 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-O 121.406 0.622 . . . . 0.0 110.0 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 20.5 mt -63.72 -45.71 88.7 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.644 -178.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.829 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.0 p -73.34 -28.58 25.84 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.368 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.13 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.24 -44.23 95.43 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 176.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.512 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.5 t80 -62.51 -45.8 91.33 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.888 173.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.72 91.55 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.943 -177.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -68.25 -41.05 81.71 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 123.608 0.763 . . . . 0.0 112.375 178.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.512 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 58.3 pttt -65.84 -40.3 91.6 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 55.5 t -71.06 -48.33 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.884 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -58.25 -45.72 87.28 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.85 -42.42 96.6 Favored Glycine 0 N--CA 1.433 -1.522 0 O-C-N 123.928 0.768 . . . . 0.0 112.744 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -58.18 -54.7 44.03 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.452 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.6 OUTLIER -67.0 -33.9 76.56 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.502 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -63.62 -45.17 91.52 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -79.05 -16.59 56.59 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 121.888 -0.507 . . . . 0.0 111.727 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.452 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 29.9 m -87.1 -27.81 22.89 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.63 167.39 15.38 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.52 0.676 . . . . 0.0 112.576 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -115.31 8.63 15.47 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.532 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.4 p -166.66 150.27 7.05 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 175.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.571 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -60.82 -34.15 74.1 Favored 'General case' 0 C--O 1.199 -1.598 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.3 175.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.78 -47.91 83.79 Favored 'General case' 0 C--O 1.219 -0.542 0 O-C-N 123.857 0.723 . . . . 0.0 109.571 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -62.96 -47.34 83.61 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.715 177.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -46.39 82.94 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.875 -176.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.414 ' HH ' HG22 ' B' ' 144' ' ' ILE . 4.7 t80 -60.92 -44.87 96.59 Favored 'General case' 0 C--O 1.208 -1.13 0 O-C-N 123.84 0.713 . . . . 0.0 109.752 177.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -58.43 -57.21 13.95 Favored 'General case' 0 C--N 1.323 -0.543 0 O-C-N 123.606 0.566 . . . . 0.0 111.815 -178.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.7 pp -65.41 -37.11 85.97 Favored 'General case' 0 C--O 1.27 2.156 0 CA-C-O 121.317 0.579 . . . . 0.0 112.167 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.49 HD23 HD22 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -70.7 -36.89 73.48 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 -179.174 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.433 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -62.72 -38.39 90.28 Favored 'General case' 0 C--O 1.209 -1.077 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.232 178.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -61.15 -51.23 69.93 Favored 'General case' 0 C--O 1.262 1.735 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.701 179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.418 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -68.55 -39.38 81.11 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.587 -0.845 . . . . 0.0 112.621 -178.155 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.555 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 6.8 tt -64.49 -44.89 96.96 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.891 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.803 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.484 ' CE1' ' HE2' ' A' ' 77' ' ' LYS . 65.3 t80 -53.4 -52.79 58.19 Favored 'General case' 0 C--O 1.259 1.574 0 C-N-CA 125.227 1.411 . . . . 0.0 111.238 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.456 ' HB3' ' HZ2' ' A' ' 74' ' ' LYS . 0.4 OUTLIER -65.67 -32.26 73.72 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.808 -178.312 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.419 HG23 ' HB2' ' A' ' 25' ' ' ALA . 1.5 mp -70.83 -35.63 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.298 176.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 72' ' ' ILE . 22.7 mm-40 -60.03 -47.58 85.25 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 122.08 0.943 . . . . 0.0 109.703 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.1 OUTLIER -72.79 -28.12 62.4 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.521 -0.872 . . . . 0.0 112.872 178.605 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.39 -53.43 57.73 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 175.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -60.35 -41.59 93.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.941 -177.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -59.1 -53.67 55.7 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.239 176.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.9 pt-20 -71.58 -37.76 70.99 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -174.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -33.36 62.34 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 . . . . . 0 N--CA 1.476 0.861 0 CA-C-O 121.852 0.834 . . . . 0.0 109.915 178.361 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 50.8 tp . . . . . 0 C--O 1.189 -2.115 0 CA-C-O 119.874 -0.108 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.403 ' HA ' ' HB3' ' B' ' 118' ' ' ASP . 59.0 tp -68.6 -40.01 80.64 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 121.334 0.588 . . . . 0.0 109.685 176.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 36.6 m -60.72 -38.1 83.97 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.14 178.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.4 m -72.27 -50.46 26.98 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-O 121.388 0.613 . . . . 0.0 111.062 174.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.403 ' HB3' ' HA ' ' B' ' 115' ' ' LEU . 3.2 t70 . . . . . 0 N--CA 1.493 1.719 0 C-N-CA 126.766 2.026 . . . . 0.0 113.941 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.43 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 25.4 ttt . . . . . 0 N--CA 1.434 -1.272 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -42.37 -53.36 4.25 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 -169.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.3 p -64.82 -50.43 66.73 Favored 'General case' 0 C--O 1.255 1.375 0 CA-C-O 121.55 0.691 . . . . 0.0 111.115 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.414 HG22 ' HH ' ' A' ' 65' ' ' TYR . 63.2 mt -58.0 -50.77 76.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.78 -177.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.43 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 0.0 OUTLIER -67.01 -40.37 85.41 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.276 -177.252 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -64.61 -58.5 6.18 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 118.954 -1.098 . . . . 0.0 111.23 -176.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.9 m -66.1 -41.1 91.07 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 -175.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -81.6 -48.05 12.26 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.349 0.499 . . . . 0.0 112.349 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.401 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 9.4 tt . . . . . 0 C--N 1.319 -0.758 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -170.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.414 ' O ' ' HD2' ' A' ' 7' ' ' HIS . 43.6 mttp . . . . . 0 N--CA 1.441 -0.901 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.43 -15.47 61.47 Favored Glycine 0 C--N 1.315 -0.639 0 O-C-N 123.428 0.455 . . . . 0.0 113.88 -174.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -72.38 -8.35 54.5 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 122.335 -0.509 . . . . 0.0 112.355 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.414 ' HD2' ' O ' ' A' ' 4' ' ' LYS . 12.5 p80 -62.4 -21.89 65.73 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.315 0.579 . . . . 0.0 110.425 178.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.17 -7.44 57.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.985 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -112.91 18.01 18.48 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.936 -178.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.57 125.48 19.05 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.23 159.24 19.52 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -176.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.01 -38.21 78.71 Favored 'General case' 0 C--O 1.208 -1.096 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 170.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.518 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 6.6 m-20 -65.86 -31.24 72.07 Favored 'General case' 0 C--O 1.202 -1.421 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.559 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -67.55 -51.88 45.44 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 179.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.581 ' O ' HG21 ' A' ' 19' ' ' VAL . 6.0 ptm180 -64.61 -46.78 81.15 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.209 -1.359 . . . . 0.0 112.536 -177.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.6 t -66.45 -23.19 66.24 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-O 121.275 0.56 . . . . 0.0 110.899 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.518 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 9.5 t60 -69.54 -47.35 64.01 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 176.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 14' ' ' LEU . 5.2 mp -65.01 -41.57 95.23 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.323 -1.308 . . . . 0.0 109.898 177.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.581 HG21 ' O ' ' A' ' 15' ' ' ARG . 67.7 t -55.81 -48.67 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 124.115 0.966 . . . . 0.0 110.39 175.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -55.75 -48.82 74.61 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.433 178.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.5 mttm -65.1 -37.31 87.07 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.026 178.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.485 ' O ' HG23 ' A' ' 26' ' ' ILE . 57.2 mt -53.51 -49.33 67.79 Favored 'General case' 0 CA--C 1.502 -0.869 0 O-C-N 123.577 0.548 . . . . 0.0 109.8 175.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.412 HG12 ' HE2' ' A' ' 40' ' ' MET . 58.6 t -54.87 -51.88 48.43 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.147 0 O-C-N 124.328 1.017 . . . . 0.0 110.172 175.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -56.72 -31.94 65.02 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -177.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.559 ' HB2' ' NE2' ' A' ' 76' ' ' GLN . . . -81.14 -45.94 15.65 Favored 'General case' 0 C--O 1.215 -0.757 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 176.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.485 HG23 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -79.9 -27.38 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-O 122.055 0.931 . . . . 0.0 111.013 -173.719 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -133.17 87.37 39.27 Favored Pre-proline 0 C--N 1.285 -2.21 0 C-N-CA 124.516 1.126 . . . . 0.0 108.997 177.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -58.37 116.1 3.01 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.164 1.909 . . . . 0.0 110.48 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.2 t -88.93 132.41 38.27 Favored Pre-proline 0 N--CA 1.424 -1.741 0 CA-C-O 121.104 0.478 . . . . 0.0 111.308 -174.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.63 -28.7 13.86 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.595 2.197 . . . . 0.0 111.331 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -148.98 155.61 40.48 Favored Pre-proline 0 C--N 1.31 -1.117 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.483 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.451 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 57.1 Cg_endo -73.52 -7.44 20.29 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.005 1.803 . . . . 0.0 114.367 179.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.59 -20.62 26.15 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 121.519 -0.738 . . . . 0.0 110.049 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.77 -12.31 58.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.863 0.839 . . . . 0.0 110.031 174.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.478 ' O ' ' HG2' ' A' ' 40' ' ' MET . 27.6 mt -89.53 2.14 54.99 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.029 -179.253 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.454 ' HZ2' ' HB3' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -132.89 9.93 4.22 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.742 0.782 . . . . 0.0 109.432 175.937 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.628 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 15.7 t70 -86.78 174.28 8.9 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 124.888 1.275 . . . . 0.0 111.004 -175.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.628 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -64.69 -29.19 70.18 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 123.266 0.626 . . . . 0.0 111.17 179.454 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.531 ' O ' HD13 ' A' ' 43' ' ' LEU . 41.2 ttm180 -66.38 -37.24 84.81 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 177.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.797 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 7.5 tpp -58.06 -35.56 71.53 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.716 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.2 pt-20 -61.64 -30.98 71.07 Favored 'General case' 0 C--O 1.209 -1.077 0 C-N-CA 118.63 -1.228 . . . . 0.0 109.369 -178.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -74.8 -46.44 36.82 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.461 177.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.531 HD13 ' O ' ' A' ' 39' ' ' ARG . 1.2 mp -55.1 -58.39 7.87 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.342 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.797 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.8 p -69.59 -29.27 40.82 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.346 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.744 -176.155 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -59.3 -47.45 85.35 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.521 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.3 t80 -59.93 -44.83 94.11 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 174.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.42 -42.29 99.34 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.055 -177.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 64.3 mttm -65.3 -44.11 88.97 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 123.2 0.6 . . . . 0.0 111.002 178.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.521 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 53.7 pttt -65.25 -40.71 94.37 Favored 'General case' 0 C--O 1.246 0.877 0 CA-C-O 121.284 0.564 . . . . 0.0 110.623 -178.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.444 HG23 ' CE2' ' A' ' 46' ' ' TYR . 43.0 t -70.95 -44.21 75.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.953 178.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -56.89 -46.66 81.73 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.09 -34.29 88.54 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.202 177.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.21 -53.8 52.34 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.005 0.431 . . . . 0.0 110.326 178.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -31.07 68.19 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -59.47 -48.82 80.18 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -76.78 -24.9 52.88 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.516 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.8 t -80.33 -11.23 59.73 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -107.53 165.63 11.27 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.975 0.416 . . . . 0.0 111.503 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -112.39 14.21 20.34 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.376 0.607 . . . . 0.0 111.529 177.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 99.6 p -162.26 153.53 17.99 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 171.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.417 ' HD3' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -58.59 -41.18 85.19 Favored 'General case' 0 C--O 1.192 -1.932 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.978 174.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -65.35 -39.92 92.98 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.435 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -63.53 -50.43 69.6 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.145 175.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -44.24 96.75 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.827 -177.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.48 -46.82 88.71 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 124.166 0.916 . . . . 0.0 110.44 177.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.518 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 24.2 t60 -63.38 -50.96 67.83 Favored 'General case' 0 C--O 1.202 -1.419 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.4 pp -64.68 -37.66 88.33 Favored 'General case' 0 C--O 1.276 2.493 0 CA-C-O 121.514 0.674 . . . . 0.0 111.877 -176.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.48 HD23 HD23 ' A' ' 18' ' ' LEU . 1.5 pp -69.59 -35.5 75.38 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 178.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.43 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.83 -35.5 80.83 Favored 'General case' 0 C--O 1.204 -1.298 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.747 177.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.518 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 26.6 mt-10 -66.23 -47.37 74.02 Favored 'General case' 0 C--O 1.252 1.233 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.861 -179.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -40.47 87.96 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 118.578 -1.249 . . . . 0.0 110.599 -178.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.43 HG22 ' HA ' ' A' ' 69' ' ' ALA . 4.4 tt -65.74 -44.13 93.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.117 -178.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.439 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 53.9 t80 -56.39 -53.11 61.25 Favored 'General case' 0 C--O 1.273 2.304 0 C-N-CA 125.36 1.464 . . . . 0.0 110.947 -178.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.5 ptpt -63.48 -39.55 94.74 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.661 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.401 HG23 ' HB3' ' A' ' 25' ' ' ALA . 1.4 mp -61.89 -39.21 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 123.343 0.402 . . . . 0.0 111.514 178.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.692 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 28.7 mm-40 -60.1 -53.48 57.28 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 6.7 ptpt -73.6 -28.78 62.0 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.459 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 8.1 tp10 -59.29 -47.94 83.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 175.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.1 pp -67.27 -37.42 83.42 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.188 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.492 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 4.7 mm-40 -61.12 -53.19 60.1 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.0 pt-20 -73.36 -32.96 64.82 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.451 ' HE2' ' HG3' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -66.07 -31.03 71.67 Favored 'General case' 0 C--N 1.352 0.674 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.095 179.081 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 51.3 mtm180 . . . . . 0 N--CA 1.454 -0.232 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.866 173.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' B' ' 118' ' ' ASP . 50.7 tp . . . . . 0 C--O 1.19 -2.042 0 N-CA-C 111.43 0.159 . . . . 0.0 111.43 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 55.6 tp -65.61 -33.73 76.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.104 0.478 . . . . 0.0 109.829 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 31.3 m -64.45 -45.38 87.67 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.417 175.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 13.0 m -67.77 -35.21 78.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 121.746 0.784 . . . . 0.0 110.095 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 6.4 t70 . . . . . 0 C--N 1.317 -0.813 0 C-N-CA 125.494 1.518 . . . . 0.0 109.903 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.46 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 44.4 ttp . . . . . 0 C--O 1.205 -1.244 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -38.24 -60.13 0.81 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 116.519 2.044 . . . . 0.0 116.519 -174.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.9 m -66.78 -39.67 87.89 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.22 0.533 . . . . 0.0 110.212 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 86.2 mt -64.98 -53.01 46.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.847 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.46 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 18.4 tt -68.37 -31.6 52.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 120.928 0.394 . . . . 0.0 112.061 -175.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -69.45 -51.52 35.38 Favored 'General case' 0 N--CA 1.419 -1.993 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.688 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 53.6 p -67.4 -42.45 83.28 Favored 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -80.62 -40.28 25.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -176.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.429 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 10.0 tt . . . . . 0 C--N 1.314 -0.952 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -171.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.419 ' HB2' ' NE1' ' A' ' 6' ' ' TRP . 13.8 ptpt . . . . . 0 N--CA 1.431 -1.39 0 CA-C-O 121.52 0.676 . . . . 0.0 109.521 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.9 -20.25 1.77 Allowed Glycine 0 N--CA 1.473 1.136 0 C-N-CA 125.7 1.619 . . . . 0.0 116.842 -171.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.419 ' NE1' ' HB2' ' A' ' 4' ' ' LYS . 65.6 p-90 -66.12 -15.07 62.79 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 117.444 0.622 . . . . 0.0 111.562 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.556 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 8.9 p80 -59.8 -25.08 64.65 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.171 0.588 . . . . 0.0 111.634 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -84.81 -9.33 58.27 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 120.921 0.391 . . . . 0.0 110.85 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.413 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 30.2 m-70 -88.83 -8.01 55.12 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 121.389 0.614 . . . . 0.0 109.557 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.593 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -106.17 140.97 22.54 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 N-CA-C 105.664 -1.976 . . . . 0.0 105.664 177.456 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.689 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -107.18 158.47 17.07 Favored 'General case' 0 C--N 1.276 -2.624 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -51.4 -41.49 60.76 Favored 'General case' 0 N--CA 1.438 -1.034 0 O-C-N 125.352 1.657 . . . . 0.0 109.993 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 18.7 m-20 -69.34 -39.35 78.21 Favored 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.04 179.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.567 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.3 tm? -63.62 -50.53 68.99 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 -179.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.689 ' HG2' ' O ' ' A' ' 11' ' ' THR 0.261 17.3 mmm-85 -51.54 -57.92 7.74 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 123.642 0.589 . . . . 0.0 109.704 175.978 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.0 t -66.02 -26.84 67.71 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.829 -171.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.438 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 11.0 t60 -70.54 -46.93 62.66 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.567 HD12 ' O ' ' A' ' 14' ' ' LEU . 4.3 mp -68.12 -38.84 82.67 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.761 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.546 HG22 ' O ' ' A' ' 15' ' ' ARG . 73.7 t -56.76 -48.44 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 C-N-CA 123.618 0.767 . . . . 0.0 110.114 174.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -56.84 -49.01 76.71 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.682 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.536 ' HZ1' HG13 ' B' ' 145' ' ' ILE . 84.2 mttt -63.43 -39.83 95.52 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.769 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.494 ' O ' HG23 ' A' ' 26' ' ' ILE . 5.7 mt -51.01 -52.84 38.9 Favored 'General case' 0 CA--C 1.506 -0.75 0 O-C-N 123.99 0.806 . . . . 0.0 110.577 174.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.448 HG13 ' HE2' ' A' ' 40' ' ' MET . 59.3 t -55.54 -51.24 60.0 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.17 0 O-C-N 124.031 0.832 . . . . 0.0 110.38 176.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -54.62 -35.94 63.96 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -175.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.2 -45.54 16.18 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.527 HG22 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.97 -23.84 15.05 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 CA-C-O 122.251 1.024 . . . . 0.0 110.925 -174.834 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.527 ' CD2' HG22 ' A' ' 26' ' ' ILE . 63.0 m-85 -134.32 94.57 17.52 Favored Pre-proline 0 C--N 1.282 -2.358 0 C-N-CA 124.85 1.26 . . . . 0.0 107.735 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.96 89.54 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 121.906 1.737 . . . . 0.0 110.655 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -59.3 128.96 86.29 Favored Pre-proline 0 N--CA 1.429 -1.49 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.307 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -73.78 -17.75 22.62 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 123.082 2.521 . . . . 0.0 112.059 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -160.13 146.36 11.86 Favored Pre-proline 0 CA--C 1.492 -1.282 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -61.35 -19.01 62.35 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 121.997 1.798 . . . . 0.0 113.913 176.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.05 -11.84 59.74 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.5 -0.88 . . . . 0.0 111.818 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.05 -6.61 53.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.862 0.839 . . . . 0.0 109.523 175.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.48 ' O ' ' HG2' ' A' ' 40' ' ' MET . 24.6 mt -91.36 0.9 57.45 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.059 -178.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -133.3 18.8 4.01 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 122.195 0.998 . . . . 0.0 108.63 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.567 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 27.9 t70 -96.29 177.18 5.79 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 113.811 -1.541 . . . . 0.0 112.041 -173.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.567 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.96 -25.11 62.58 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 124.203 1.001 . . . . 0.0 111.058 179.173 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.572 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 43.0 ttm180 -76.11 -27.84 57.25 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 176.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.826 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 10.7 tpp -59.02 -36.64 75.3 Favored 'General case' 0 C--O 1.197 -1.675 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.167 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.495 ' O ' ' HB3' ' A' ' 45' ' ' ALA . 9.4 pt-20 -59.24 -32.97 70.46 Favored 'General case' 0 C--O 1.189 -2.103 0 C-N-CA 119.558 -0.857 . . . . 0.0 109.952 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -76.57 -43.33 39.32 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 123.23 0.612 . . . . 0.0 110.465 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.0 mt -63.26 -48.62 77.44 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.199 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.826 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.3 p -73.28 -28.33 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.719 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.137 -178.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -59.81 -45.67 91.64 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.52 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 13.0 t80 -61.79 -47.86 83.23 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.917 174.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.06 -43.05 91.67 Favored 'General case' 0 C--O 1.203 -1.372 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.234 -178.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -66.06 -39.96 90.51 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 123.7 0.8 . . . . 0.0 112.181 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -69.84 -37.36 76.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.359 0.599 . . . . 0.0 109.712 -178.287 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.411 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 65.3 t -70.98 -50.0 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.101 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.416 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.5 tm-20 -57.11 -46.79 82.33 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.964 0.906 . . . . 0.0 109.575 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.67 -40.47 98.04 Favored Glycine 0 CA--C 1.507 -0.413 0 O-C-N 123.587 0.555 . . . . 0.0 112.235 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -59.66 -54.34 47.58 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 122.785 0.434 . . . . 0.0 110.799 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.451 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.0 OUTLIER -64.99 -34.17 77.81 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 178.118 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.556 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 68.1 t80 -59.48 -52.74 64.28 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 174.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.84 -18.55 61.44 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-O 121.705 0.764 . . . . 0.0 111.837 -179.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.451 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 17.4 m -85.46 -27.16 25.89 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -87.55 167.23 14.12 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -176.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -108.6 5.83 25.37 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.641 177.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.526 ' HB2' ' OD1' ' A' ' 62' ' ' ASP . 42.0 p -169.87 154.33 5.22 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 178.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.593 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -62.46 -36.24 81.82 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-O 121.247 0.546 . . . . 0.0 110.51 179.859 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.526 ' OD1' ' HB2' ' A' ' 60' ' ' SER . 1.2 p-10 -62.79 -38.62 91.4 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 124.548 1.139 . . . . 0.0 111.202 177.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -70.57 -44.35 67.58 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.705 0.288 . . . . 0.0 110.874 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -43.83 85.26 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.331 -177.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.64 -40.11 93.72 Favored 'General case' 0 C--O 1.199 -1.566 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.514 176.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -60.2 -57.73 11.57 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.238 0.336 . . . . 0.0 111.633 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.445 HD12 ' CB ' ' A' ' 54' ' ' MET . 4.7 pp -69.1 -30.43 68.72 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.717 -174.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.506 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -76.08 -32.57 59.31 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 119.85 -0.74 . . . . 0.0 109.073 178.366 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.428 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -66.47 -36.8 83.66 Favored 'General case' 0 C--O 1.206 -1.234 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.37 -44.14 92.34 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.757 177.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.554 ' O ' HD12 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.96 -39.05 79.71 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 119.966 -0.694 . . . . 0.0 111.137 179.011 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.428 HG21 ' HA ' ' A' ' 69' ' ' ALA . 10.5 tt -68.91 -40.61 81.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.302 -179.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.548 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.1 t80 -57.49 -51.22 70.33 Favored 'General case' 0 C--O 1.261 1.669 0 C-N-CA 124.711 1.204 . . . . 0.0 111.303 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.8 ptpt -63.53 -40.6 97.44 Favored 'General case' 0 C--O 1.199 -1.565 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.554 HD12 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -60.7 -38.77 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 O-C-N 123.717 0.636 . . . . 0.0 111.01 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.513 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 28.1 mt-30 -69.26 -45.0 70.8 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 120.265 -0.574 . . . . 0.0 111.855 -177.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 10.9 ptpt -74.35 -27.6 60.75 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 118.858 -1.137 . . . . 0.0 112.362 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.528 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 7.1 tp10 -61.02 -49.2 78.38 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 174.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -65.9 -42.13 90.63 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -177.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.507 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 9.6 pt-20 -69.48 -39.18 77.81 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 119.444 -0.903 . . . . 0.0 112.652 -177.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -69.44 -39.59 77.73 Favored 'General case' 0 C--O 1.213 -0.817 0 C-N-CA 118.877 -1.129 . . . . 0.0 110.534 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.413 ' HD3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -69.25 -31.66 70.35 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 120.564 -0.454 . . . . 0.0 111.016 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 5.5 mmt180 . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.913 178.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.431 HD22 ' HB3' ' A' ' 79' ' ' LEU . 56.0 tp . . . . . 0 C--O 1.208 -1.123 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.413 HD13 ' HD3' ' A' ' 82' ' ' LYS . 61.8 tp -71.22 -38.4 72.0 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.372 -0.83 . . . . 0.0 110.463 178.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 3.1 t -71.32 -35.84 71.37 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 119.834 -0.746 . . . . 0.0 111.644 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.1 p -69.84 -33.33 72.15 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.595 0.712 . . . . 0.0 109.874 175.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 11.9 t70 . . . . . 0 C--N 1.318 -0.794 0 C-N-CA 124.621 1.168 . . . . 0.0 109.976 176.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.549 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 21.1 ttt . . . . . 0 C--O 1.204 -1.305 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -34.26 -59.99 0.42 Allowed 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -172.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.4 m -69.22 -38.3 78.48 Favored 'General case' 0 C--O 1.253 1.247 0 CA-C-O 121.587 0.708 . . . . 0.0 110.43 -176.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 58.6 mt -69.94 -46.77 72.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.415 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.549 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 0.0 OUTLIER -63.56 -36.65 77.16 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.76 -179.051 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -61.4 -65.41 0.7 Allowed 'General case' 0 N--CA 1.428 -1.575 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.395 178.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.2 p -64.2 -54.02 40.08 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -173.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -80.78 -35.14 33.56 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -173.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.416 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 10.1 tt . . . . . 0 N--CA 1.441 -0.917 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -171.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.41 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 10.8 ptpt . . . . . 0 N--CA 1.444 -0.744 0 CA-C-O 121.557 0.694 . . . . 0.0 110.772 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.18 -22.28 13.6 Favored Glycine 0 CA--C 1.521 0.44 0 CA-C-N 114.338 -1.301 . . . . 0.0 115.83 -175.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.41 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 56.9 p-90 -64.37 -9.41 17.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 117.734 0.767 . . . . 0.0 112.279 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -62.58 -17.04 59.27 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 122.382 0.273 . . . . 0.0 111.621 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -86.44 -10.5 54.1 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.268 0.556 . . . . 0.0 110.359 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.421 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 24.7 m-70 -87.98 5.94 38.33 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.68 0.752 . . . . 0.0 109.575 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.593 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -133.51 114.01 19.86 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.703 0 N-CA-C 105.285 -2.117 . . . . 0.0 105.285 178.564 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.72 174.74 7.84 Favored 'General case' 0 C--N 1.276 -2.592 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -28.79 70.33 Favored 'General case' 0 C--O 1.202 -1.399 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -57.72 -48.25 80.11 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 178.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.546 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.4 tm? -66.4 -54.45 24.21 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -175.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.545 ' O ' HG21 ' A' ' 19' ' ' VAL . 2.8 ptm180 -60.9 -45.16 95.7 Favored 'General case' 0 N--CA 1.42 -1.956 0 CA-C-N 114.629 -1.169 . . . . 0.0 113.996 -178.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.1 t -65.3 -30.35 71.2 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 117.816 0.28 . . . . 0.0 110.756 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -66.31 -45.16 81.27 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.546 HD11 ' O ' ' A' ' 14' ' ' LEU . 6.3 mp -66.33 -40.23 89.75 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.497 178.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.545 HG21 ' O ' ' A' ' 15' ' ' ARG . 53.5 t -58.98 -49.75 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 124.022 0.929 . . . . 0.0 110.271 175.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -54.84 -44.13 73.66 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.969 0.908 . . . . 0.0 110.04 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -67.96 -41.64 82.14 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.103 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.488 ' O ' HG23 ' A' ' 26' ' ' ILE . 55.5 mt -51.91 -48.03 64.36 Favored 'General case' 0 CA--C 1.501 -0.909 0 O-C-N 123.515 0.509 . . . . 0.0 110.025 175.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.433 HG12 ' HE3' ' A' ' 40' ' ' MET . 41.8 t -55.81 -55.42 17.91 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.881 0 O-C-N 124.284 0.99 . . . . 0.0 110.471 175.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -57.21 -29.7 63.95 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -176.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.48 -45.91 15.3 Favored 'General case' 0 C--O 1.21 -1.007 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 176.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.488 HG23 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.86 -26.31 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-O 121.961 0.886 . . . . 0.0 110.141 -174.461 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.496 ' CD2' HD22 ' A' ' 43' ' ' LEU . 14.4 m-85 -138.81 88.09 14.07 Favored Pre-proline 0 N--CA 1.418 -2.058 0 C-N-CA 125.394 1.477 . . . . 0.0 108.717 177.147 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -57.09 106.33 0.22 Allowed 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 121.74 1.626 . . . . 0.0 109.214 177.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.0 t -66.85 130.08 94.0 Favored Pre-proline 0 N--CA 1.422 -1.833 0 CA-C-O 121.161 0.505 . . . . 0.0 111.164 -174.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.91 -31.6 12.42 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.534 2.156 . . . . 0.0 111.696 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -144.81 148.1 37.94 Favored Pre-proline 0 CA--C 1.49 -1.344 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 -176.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -69.12 -12.98 35.44 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.566 1.511 . . . . 0.0 112.286 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.64 -14.53 48.35 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.408 177.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.83 -11.19 60.5 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.877 0.846 . . . . 0.0 109.037 176.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.434 ' HA ' ' CE ' ' A' ' 40' ' ' MET . 23.9 mt -86.92 5.47 36.9 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.414 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -136.12 6.64 3.11 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.82 -0.55 . . . . 0.0 111.556 173.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.637 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 30.9 t70 -81.31 177.56 8.92 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.698 -176.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.637 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.93 -19.3 62.59 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.566 0.698 . . . . 0.0 110.468 175.225 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.604 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 17.3 tpp180 -70.3 -31.94 69.5 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.571 ' O ' HG21 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -57.95 -41.01 81.95 Favored 'General case' 0 CA--C 1.478 -1.803 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.149 -179.424 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 7.7 pt-20 -60.15 -33.98 72.91 Favored 'General case' 0 C--O 1.208 -1.122 0 O-C-N 123.785 0.678 . . . . 0.0 110.763 -175.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.467 HD21 HD21 ' A' ' 43' ' ' LEU . 6.9 t30 -73.6 -44.66 56.58 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.38 0.609 . . . . 0.0 109.901 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 8.8 mt -65.53 -45.73 82.35 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.262 -176.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.571 HG21 ' O ' ' A' ' 40' ' ' MET . 29.1 m -69.33 -31.45 49.6 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.139 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.205 178.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.56 -45.2 89.48 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 177.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.506 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.4 t80 -63.17 -48.6 77.72 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.57 0.544 . . . . 0.0 110.373 173.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.83 -42.04 88.29 Favored 'General case' 0 C--O 1.201 -1.499 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.188 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 64.5 mttm -68.36 -41.12 81.1 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 123.843 0.857 . . . . 0.0 111.669 178.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.506 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 57.3 pttt -67.06 -39.33 86.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.728 0.775 . . . . 0.0 109.546 -178.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.453 HG22 ' CE2' ' A' ' 46' ' ' TYR . 42.9 t -72.54 -45.9 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.14 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.416 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.7 tm-20 -58.02 -47.53 82.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 177.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.89 -39.35 95.38 Favored Glycine 0 N--CA 1.449 -0.48 0 O-C-N 123.646 0.591 . . . . 0.0 112.436 178.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -59.09 -54.26 49.03 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 123.703 0.801 . . . . 0.0 110.741 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.449 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.4 OUTLIER -69.98 -28.33 65.45 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 178.123 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -66.25 -47.55 73.4 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -73.48 -26.4 60.89 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.187 0.517 . . . . 0.0 111.334 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 25.6 m -75.89 -33.04 59.92 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.27 170.39 15.45 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.432 0.634 . . . . 0.0 112.237 -178.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -120.18 13.15 11.98 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.423 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.8 p -166.86 152.85 8.15 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.593 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -64.75 -27.4 68.87 Favored 'General case' 0 C--O 1.204 -1.328 0 C-N-CA 118.43 -1.308 . . . . 0.0 110.22 175.328 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -63.07 -47.71 81.75 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.78 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.1 -44.27 89.36 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.317 176.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -45.35 86.51 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.583 -177.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.54 -41.99 98.16 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.215 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 -60.66 -52.69 64.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.497 ' O ' ' HB2' ' A' ' 70' ' ' GLU . 4.5 pp -72.04 -33.74 68.22 Favored 'General case' 0 C--O 1.264 1.848 0 CA-C-O 121.305 0.574 . . . . 0.0 111.969 -175.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.473 HD23 HD22 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -70.76 -36.5 73.13 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 179.2 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.464 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -60.94 -39.87 91.08 Favored 'General case' 0 C--O 1.188 -2.151 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.316 175.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 42.5 mm-40 -55.77 -51.37 67.64 Favored 'General case' 0 C--O 1.253 1.282 0 C-N-CA 122.697 0.399 . . . . 0.0 111.704 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.81 -39.01 76.79 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 118.63 -1.228 . . . . 0.0 111.924 -177.486 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.464 HG22 ' HA ' ' A' ' 69' ' ' ALA . 8.4 tt -67.65 -45.19 85.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.662 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.546 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 47.7 t80 -54.95 -51.88 64.75 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 125.571 1.548 . . . . 0.0 110.684 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.531 ' HB3' ' HZ3' ' A' ' 74' ' ' LYS . 0.4 OUTLIER -63.21 -41.22 99.12 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 120.471 -0.492 . . . . 0.0 110.53 -179.387 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -62.83 -35.05 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 O-C-N 123.177 0.298 . . . . 0.0 111.45 178.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.517 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 5.1 mt-30 -70.75 -44.29 67.08 Favored 'General case' 0 CA--C 1.483 -1.634 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.867 -177.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 12.4 ptpt -74.55 -27.4 60.5 Favored 'General case' 0 N--CA 1.418 -2.027 0 C-N-CA 119.017 -1.073 . . . . 0.0 111.898 176.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -67.46 -42.71 82.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 176.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -65.98 -39.34 90.27 Favored 'General case' 0 C--O 1.212 -0.878 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.088 177.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -58.4 -52.72 64.44 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 123.726 0.641 . . . . 0.0 111.111 176.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.41 -43.23 95.02 Favored 'General case' 0 C--O 1.211 -0.926 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.982 -178.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.409 ' C ' ' HD2' ' A' ' 82' ' ' LYS . 0.2 OUTLIER -67.4 -33.47 75.25 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.122 0.486 . . . . 0.0 110.677 -177.799 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.622 -179.017 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.456 HD22 ' HB3' ' A' ' 79' ' ' LEU . 26.5 tp . . . . . 0 N--CA 1.448 -0.563 0 CA-C-O 121.259 0.552 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 40.2 tp -70.12 -33.42 71.81 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 32.3 m -64.64 -43.09 94.8 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 174.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.6 m -61.58 -41.99 98.2 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.429 0.633 . . . . 0.0 109.761 176.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.4 t70 . . . . . 0 C--N 1.323 -0.552 0 C-N-CA 124.144 0.977 . . . . 0.0 110.788 176.867 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 16.0 ptm . . . . . 0 C--O 1.209 -1.049 0 N-CA-C 111.157 0.058 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -10.4 -74.18 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 128.196 2.598 . . . . 0.0 115.554 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 5.7 m -66.54 -47.48 72.74 Favored 'General case' 0 C--O 1.253 1.251 0 C-N-CA 123.589 0.756 . . . . 0.0 112.191 -175.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 62.5 mt -65.62 -44.49 93.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.887 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 12.0 tt -67.49 -36.63 76.92 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.481 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.855 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 45.6 ttt180 -55.71 -50.5 70.14 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.9 m -60.97 -51.86 67.46 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.651 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -76.52 -43.32 39.88 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -174.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.419 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 2.5 tm? . . . . . 0 C--N 1.296 -1.741 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.721 -172.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.436 ' HD2' ' HE1' ' A' ' 6' ' ' TRP . 28.8 mtmm . . . . . 0 N--CA 1.426 -1.65 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -52.2 -25.1 17.56 Favored Glycine 0 C--O 1.243 0.709 0 N-CA-C 116.023 1.169 . . . . 0.0 116.023 -172.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.436 ' HE1' ' HD2' ' A' ' 4' ' ' LYS . 66.2 p-90 -66.59 -14.72 62.75 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 117.412 0.606 . . . . 0.0 112.009 178.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.404 ' HB2' ' HH ' ' A' ' 55' ' ' TYR . 0.7 OUTLIER -59.39 -14.12 10.92 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 177.12 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -84.86 -10.26 57.31 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.46 0.648 . . . . 0.0 110.422 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -95.04 3.58 54.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.211 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.0 p -134.74 125.85 46.75 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.021 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.459 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -93.84 157.83 15.94 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.52 -177.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -43.05 64.6 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.071 0.948 . . . . 0.0 110.049 175.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.414 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 1.9 m-20 -57.47 -37.23 72.55 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.245 -0.888 . . . . 0.0 112.191 -179.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.464 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.3 tm? -70.4 -51.45 29.48 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 -176.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.494 ' O ' HG21 ' A' ' 19' ' ' VAL . 3.9 ptm180 -66.17 -43.73 86.08 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.447 -1.251 . . . . 0.0 113.164 -176.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.5 t -68.42 -24.46 64.74 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-O 121.181 0.515 . . . . 0.0 109.672 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 20.2 t60 -68.92 -44.58 72.84 Favored 'General case' 0 C--O 1.246 0.915 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 176.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.494 HD21 HD23 ' A' ' 68' ' ' LEU . 3.7 mp -65.78 -40.65 92.2 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.705 -1.134 . . . . 0.0 110.171 177.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.494 HG21 ' O ' ' A' ' 15' ' ' ARG . 60.6 t -55.69 -48.46 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.602 0.761 . . . . 0.0 110.101 174.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -53.65 -50.43 65.78 Favored 'General case' 0 C--O 1.249 1.053 0 C-N-CA 123.622 0.769 . . . . 0.0 110.607 177.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -64.14 -39.8 94.8 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.814 178.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.533 ' O ' HG23 ' A' ' 26' ' ' ILE . 20.2 mt -50.96 -53.34 33.87 Favored 'General case' 0 CA--C 1.505 -0.782 0 O-C-N 123.797 0.686 . . . . 0.0 110.559 175.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.415 HG12 ' HE1' ' A' ' 40' ' ' MET . 54.7 t -54.8 -50.11 63.77 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.766 0 O-C-N 124.173 0.921 . . . . 0.0 110.786 176.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -55.34 -38.79 69.23 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -177.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.16 -44.56 17.7 Favored 'General case' 0 C--O 1.206 -1.235 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.834 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.574 HG22 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.22 -25.92 16.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.529 0.681 . . . . 0.0 110.725 -175.0 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.574 ' CD2' HG22 ' A' ' 26' ' ' ILE . 62.9 m-85 -128.54 91.51 43.41 Favored Pre-proline 0 C--N 1.293 -1.888 0 C-N-CA 123.858 0.863 . . . . 0.0 109.446 178.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.84 97.52 0.18 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 122.081 1.854 . . . . 0.0 110.172 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.6 t -69.73 138.37 88.17 Favored Pre-proline 0 N--CA 1.424 -1.762 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.512 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.53 -34.99 8.63 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 122.515 2.143 . . . . 0.0 111.376 178.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -142.92 150.84 54.58 Favored Pre-proline 0 CA--C 1.489 -1.381 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -65.82 -13.39 39.6 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.1 1.866 . . . . 0.0 112.088 175.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.4 -9.71 55.76 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.369 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.37 -8.77 59.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.378 1.085 . . . . 0.0 108.564 176.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.441 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.2 mt -85.6 1.57 48.61 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 114.033 -1.439 . . . . 0.0 110.291 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -133.32 20.07 4.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 122.2 1.0 . . . . 0.0 108.699 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.67 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 27.1 t70 -98.03 177.09 5.53 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.642 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.67 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -68.69 -29.03 67.38 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.725 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.569 ' O ' HD13 ' A' ' 43' ' ' LEU . 4.3 tpm_? -63.95 -34.45 78.0 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.603 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.9 tpp -58.54 -32.73 69.15 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 114.266 -1.334 . . . . 0.0 112.724 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -64.36 -31.61 72.89 Favored 'General case' 0 C--O 1.203 -1.358 0 C-N-CA 118.727 -1.189 . . . . 0.0 109.845 -178.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -72.77 -46.08 55.24 Favored 'General case' 0 CA--C 1.5 -0.949 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 175.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.569 HD13 ' O ' ' A' ' 39' ' ' ARG . 1.7 mp -53.19 -55.97 20.04 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 113.928 -1.487 . . . . 0.0 110.744 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.603 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.0 p -73.26 -29.08 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.034 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.571 -175.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.79 -47.67 84.78 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.514 ' CZ ' HG21 ' A' ' 50' ' ' VAL . 3.0 t80 -61.15 -46.56 90.01 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.148 175.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.48 -44.45 93.04 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 120.854 -0.339 . . . . 0.0 111.21 -177.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -62.83 -46.24 88.83 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 123.32 0.648 . . . . 0.0 111.829 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.5 pttp -63.55 -41.84 98.41 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-O 121.306 0.574 . . . . 0.0 110.605 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.514 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 50.8 t -70.47 -43.56 77.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.053 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -58.48 -44.6 89.4 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.7 -42.49 96.34 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.179 178.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.35 -54.62 44.66 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.464 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -67.02 -30.21 70.24 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 179.612 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.404 ' HH ' ' HB2' ' A' ' 7' ' ' HIS . 61.5 t80 -65.6 -50.74 63.98 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 176.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.426 ' CD ' ' HZ3' ' A' ' 4' ' ' LYS . 20.0 mm-40 -69.4 -25.12 63.98 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.246 -0.434 . . . . 0.0 112.07 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.435 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 34.5 m -79.18 -27.25 42.63 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 124.408 1.083 . . . . 0.0 113.431 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.19 162.82 16.47 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -110.71 8.32 22.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.54 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.6 p -162.49 157.97 23.02 Favored 'General case' 0 CA--C 1.487 -1.452 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 174.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.1 -26.45 62.15 Favored 'General case' 0 C--O 1.2 -1.515 0 C-N-CA 118.921 -1.112 . . . . 0.0 110.131 178.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -64.72 -45.3 87.13 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.502 176.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -63.26 -44.56 94.81 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.022 175.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -46.45 79.18 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.694 -177.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.423 ' HH ' HD11 ' B' ' 145' ' ' ILE . 2.2 t80 -61.86 -44.79 96.12 Favored 'General case' 0 C--O 1.209 -1.056 0 O-C-N 123.839 0.712 . . . . 0.0 110.318 177.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.454 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 13.8 t60 -65.46 -47.16 77.09 Favored 'General case' 0 C--O 1.209 -1.038 0 O-C-N 123.157 0.286 . . . . 0.0 111.475 -177.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.406 HD12 ' CB ' ' A' ' 54' ' ' MET . 4.0 pp -70.5 -33.23 70.98 Favored 'General case' 0 C--O 1.255 1.381 0 C-N-CA 120.256 -0.578 . . . . 0.0 111.528 -176.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.499 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 0.8 OUTLIER -73.23 -33.6 65.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 178.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.568 ' O ' ' HB2' ' A' ' 73' ' ' TYR . . . -63.7 -41.97 98.04 Favored 'General case' 0 C--O 1.183 -2.439 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.906 175.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 38.3 mm-40 -57.11 -47.37 81.25 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-O 121.462 0.649 . . . . 0.0 111.314 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -70.23 -38.62 75.26 Favored 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.908 -178.149 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.436 HG21 ' HA ' ' A' ' 69' ' ' ALA . 9.4 tt -69.68 -36.57 71.0 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-O 121.765 0.793 . . . . 0.0 109.794 -179.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.568 ' HB2' ' O ' ' A' ' 69' ' ' ALA . 16.9 t80 -58.55 -55.44 34.99 Favored 'General case' 0 C--O 1.279 2.646 0 C-N-CA 126.656 1.983 . . . . 0.0 109.826 -178.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.7 ptpt -64.87 -33.14 75.29 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.793 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -68.11 -41.79 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 O-C-N 123.481 0.488 . . . . 0.0 111.905 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.555 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 29.1 mt-30 -62.42 -49.01 77.17 Favored 'General case' 0 C--O 1.262 1.745 0 CA-C-O 121.198 0.523 . . . . 0.0 111.253 -178.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.2 ptpt -69.33 -31.18 69.46 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 118.75 -1.18 . . . . 0.0 111.848 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 11.4 tp10 -64.99 -47.53 77.19 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -60.4 -43.72 96.41 Favored 'General case' 0 CA--C 1.492 -1.285 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.493 -177.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.418 ' N ' HD12 ' A' ' 79' ' ' LEU . 11.5 pt-20 -67.1 -39.15 86.66 Favored 'General case' 0 C--O 1.258 1.52 0 C-N-CA 119.35 -0.94 . . . . 0.0 112.214 -178.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -73.8 -39.26 64.23 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 119.892 -0.723 . . . . 0.0 112.211 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.489 ' C ' ' HD2' ' A' ' 82' ' ' LYS . 0.2 OUTLIER -73.44 -31.93 64.1 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 110.971 -179.429 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 . . . . . 0 CA--C 1.506 -0.74 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.118 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.514 HD23 ' HB3' ' A' ' 79' ' ' LEU . 58.3 tp . . . . . 0 C--O 1.233 0.235 0 CA-C-O 120.969 0.414 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 35.0 tp -70.69 -31.05 67.8 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 89.9 m -67.44 -43.04 82.13 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 175.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 15.0 m -57.98 -46.37 85.28 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.708 0.765 . . . . 0.0 110.408 176.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 13.1 t70 . . . . . 0 C--N 1.313 -1.012 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.745 -179.707 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 5.0 ttt . . . . . 0 C--O 1.168 -3.204 0 N-CA-C 114.52 1.304 . . . . 0.0 114.52 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' B' ' 142' ' ' GLU . 1.6 mp0 -30.14 -65.61 0.11 Allowed 'General case' 0 N--CA 1.503 2.176 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 -170.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 9.1 p -68.7 -37.97 79.94 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.407 0.622 . . . . 0.0 111.017 -177.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 42.7 mm -64.39 -48.05 86.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.94 -179.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.423 HD11 ' HH ' ' A' ' 65' ' ' TYR . 10.0 tp -65.6 -42.04 92.02 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.443 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.356 -176.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -62.78 -56.35 18.31 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 119.018 -1.073 . . . . 0.0 111.028 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 25.5 t -62.66 -50.93 69.24 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.519 -173.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -80.67 -37.02 31.58 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -174.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.443 ' HA ' ' HB2' ' A' ' 69' ' ' ALA . 2.3 tm? . . . . . 0 CA--C 1.53 0.208 0 CA-C-O 118.444 -0.788 . . . . 0.0 111.699 -175.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.5 mttp . . . . . 0 N--CA 1.424 -1.766 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.21 -20.76 44.66 Favored Glycine 0 C--N 1.313 -0.721 0 O-C-N 124.045 0.841 . . . . 0.0 114.533 -174.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -69.58 -8.97 51.96 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 178.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.405 ' CB ' ' HH ' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -65.01 -20.4 66.48 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -179.159 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -80.85 -8.54 59.74 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.265 0.555 . . . . 0.0 110.431 178.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -103.54 5.15 36.52 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 121.464 0.649 . . . . 0.0 111.198 -176.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.613 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 0.9 OUTLIER -122.13 120.43 61.3 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.714 0 N-CA-C 105.132 -2.173 . . . . 0.0 105.132 175.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.482 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.5 m -74.6 149.7 39.96 Favored 'General case' 0 N--CA 1.407 -2.591 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.27 -38.18 85.83 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.07 -30.72 71.29 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.29 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.459 ' O ' HD11 ' A' ' 18' ' ' LEU . 2.7 tm? -75.45 -53.68 8.28 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -177.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.522 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.2 ptm180 -56.44 -44.99 81.01 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 176.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.4 t -69.37 -25.86 64.38 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 121.291 -0.163 . . . . 0.0 110.912 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.448 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 30.6 t60 -70.38 -37.11 74.48 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.495 HD23 HD23 ' A' ' 68' ' ' LEU . 1.7 mp -66.13 -42.72 88.74 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.49 175.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.9 t -55.83 -50.72 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.896 0.878 . . . . 0.0 109.878 174.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -52.51 -47.15 66.82 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.738 176.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.448 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 61.4 mttm -66.98 -40.15 87.35 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.76 178.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.508 ' O ' HG23 ' A' ' 26' ' ' ILE . 64.9 mt -51.8 -51.06 59.2 Favored 'General case' 0 CA--C 1.506 -0.73 0 O-C-N 123.901 0.751 . . . . 0.0 110.252 175.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.451 HG12 ' HE1' ' A' ' 40' ' ' MET . 78.1 t -54.55 -53.14 33.87 Favored 'Isoleucine or valine' 0 C--O 1.186 -2.283 0 O-C-N 124.164 0.915 . . . . 0.0 110.258 176.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.74 -36.41 62.29 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -176.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.79 -45.71 15.22 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.508 HG23 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.77 -26.37 16.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.832 0.825 . . . . 0.0 110.49 -174.698 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.501 ' CD2' HG22 ' A' ' 26' ' ' ILE . 50.6 m-85 -130.69 93.52 31.51 Favored Pre-proline 0 C--N 1.285 -2.23 0 C-N-CA 124.187 0.995 . . . . 0.0 109.877 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.428 ' CG ' ' HA ' ' B' ' 118' ' ' ASP . 35.9 Cg_endo -65.88 109.01 1.39 Allowed 'Trans proline' 0 C--O 1.249 1.027 0 C-N-CA 121.7 1.6 . . . . 0.0 109.904 176.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.4 t -76.07 140.14 69.71 Favored Pre-proline 0 N--CA 1.43 -1.426 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.196 -174.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -72.21 -36.2 5.89 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.336 2.024 . . . . 0.0 111.101 176.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -146.97 146.3 25.48 Favored Pre-proline 0 C--N 1.313 -1.001 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 -176.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -55.39 -24.11 41.59 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 122.413 2.076 . . . . 0.0 114.132 175.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.47 -11.49 59.85 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.082 -1.011 . . . . 0.0 111.856 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.0 -9.15 58.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.665 0.745 . . . . 0.0 109.557 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.466 ' O ' ' HG2' ' A' ' 40' ' ' MET . 18.1 mt -90.15 -5.55 56.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.085 -0.962 . . . . 0.0 110.39 -178.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -133.81 33.16 3.47 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.631 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 32.5 t70 -112.13 176.59 4.96 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 113.76 -1.564 . . . . 0.0 110.65 -173.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.631 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.28 -25.59 62.51 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-O 121.196 0.522 . . . . 0.0 110.635 176.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.54 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 5.2 tpm_? -71.15 -30.83 66.94 Favored 'General case' 0 C--O 1.252 1.219 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 176.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.802 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.5 tpp -58.25 -39.91 80.39 Favored 'General case' 0 C--O 1.197 -1.66 0 CA-C-N 114.483 -1.235 . . . . 0.0 112.683 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 10.9 pt-20 -59.05 -30.38 68.01 Favored 'General case' 0 C--O 1.205 -1.281 0 C-N-CA 119.521 -0.871 . . . . 0.0 110.919 -177.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -74.77 -46.18 38.77 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.287 0.565 . . . . 0.0 109.902 176.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.2 mt -60.2 -51.14 70.86 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.715 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.802 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -71.88 -27.88 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.646 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.376 -178.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -58.49 -46.68 86.19 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.511 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 7.5 t80 -59.76 -47.1 87.02 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.4 174.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.49 97.83 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 120.369 -0.533 . . . . 0.0 111.306 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -65.14 -45.81 83.49 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.206 0.602 . . . . 0.0 111.34 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.511 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 56.5 pttt -63.71 -38.04 89.63 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-O 121.726 0.774 . . . . 0.0 110.321 -178.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.486 HG21 ' CE1' ' A' ' 46' ' ' TYR . 39.9 t -73.82 -42.84 53.9 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.225 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.134 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.428 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 15.0 tm-20 -58.6 -44.4 89.88 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.55 -43.51 97.55 Favored Glycine 0 CA--C 1.501 -0.783 0 O-C-N 123.626 0.579 . . . . 0.0 111.949 177.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -55.48 -54.36 44.79 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 123.025 0.53 . . . . 0.0 111.718 177.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.469 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -70.76 -29.77 66.09 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.405 ' HH ' ' CB ' ' A' ' 7' ' ' HIS . 52.5 t80 -64.64 -49.84 69.43 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 177.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -76.33 -14.23 60.11 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.22 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.1 t -86.77 -17.72 32.84 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.848 0.356 . . . . 0.0 110.106 176.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.43 171.81 8.16 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-O 121.225 0.536 . . . . 0.0 112.045 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -124.02 14.6 9.18 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.723 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 82.5 p -167.9 156.59 9.29 Favored 'General case' 0 CA--C 1.486 -1.505 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 175.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.613 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -67.36 -31.32 71.49 Favored 'General case' 0 C--O 1.189 -2.128 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.625 175.03 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -58.78 -47.88 83.18 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 123.725 0.641 . . . . 0.0 110.499 178.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -65.96 -45.12 82.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.57 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.11 -46.46 77.51 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.856 -176.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.441 ' HH ' HG22 ' B' ' 144' ' ' ILE . 4.2 t80 -60.62 -44.29 96.5 Favored 'General case' 0 C--O 1.204 -1.323 0 C-N-CA 123.831 0.852 . . . . 0.0 109.283 177.238 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.443 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 7.4 t60 -58.88 -57.32 13.58 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 123.261 0.624 . . . . 0.0 110.925 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 pp -68.03 -33.21 74.16 Favored 'General case' 0 C--O 1.258 1.537 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -173.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.495 HD23 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -72.34 -37.78 68.78 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 179.573 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.526 ' HB3' ' HA ' ' B' ' 149' ' ' LEU . . . -60.39 -40.11 89.72 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.552 176.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 55.7 mm-40 -60.78 -46.11 91.75 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.01 178.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -42.5 75.3 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 118.769 -1.172 . . . . 0.0 111.23 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.452 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.5 tt -63.13 -42.26 95.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.751 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -57.19 -52.97 63.18 Favored 'General case' 0 C--O 1.274 2.366 0 C-N-CA 125.054 1.342 . . . . 0.0 110.379 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.456 ' HZ1' ' HB3' ' A' ' 74' ' ' LYS . 0.5 OUTLIER -65.6 -32.06 73.44 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.571 -178.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -68.1 -37.12 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 123.007 0.523 . . . . 0.0 111.11 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.552 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 34.9 mt-30 -65.59 -45.67 82.3 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 121.189 0.519 . . . . 0.0 110.751 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.516 ' HZ2' ' HB3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -70.32 -27.88 64.72 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 118.472 -1.291 . . . . 0.0 113.034 175.605 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -63.44 -48.42 77.81 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 175.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.7 pp -62.9 -40.46 97.64 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.06 -178.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.425 ' N ' HD11 ' A' ' 79' ' ' LEU . 0.7 OUTLIER -60.39 -53.33 58.9 Favored 'General case' 0 N--CA 1.412 -2.344 0 O-C-N 123.956 0.785 . . . . 0.0 110.467 -179.61 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -72.35 -33.17 67.09 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 118.982 -1.087 . . . . 0.0 112.54 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.415 ' HE3' ' CG ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -67.21 -34.14 76.87 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.396 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.713 178.96 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.521 ' HA ' ' OG ' ' B' ' 117' ' ' SER . 36.9 tp . . . . . 0 C--O 1.219 -0.529 0 CA-C-O 120.829 0.347 . . . . 0.0 111.908 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.0 tp -74.89 -44.36 49.27 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 173.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 42.2 m -68.9 -36.68 78.33 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 114.506 -1.224 . . . . 0.0 111.062 -179.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 117' ' ' SER . . . . . 0.521 ' OG ' ' HA ' ' B' ' 114' ' ' LEU . 68.2 p -75.95 -34.98 59.85 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.011 0.434 . . . . 0.0 110.108 178.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 20.6 t70 . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 121.597 0.713 . . . . 0.0 109.409 175.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.483 ' O ' HG12 ' B' ' 145' ' ' ILE . 19.4 ttt . . . . . 0 N--CA 1.418 -2.068 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 41.3 mt-10 -55.61 -42.25 74.62 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -174.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.4 p -59.26 -51.65 69.06 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.36 0.6 . . . . 0.0 110.722 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . 0.441 HG22 ' HH ' ' A' ' 65' ' ' TYR . 41.1 mt -67.3 -47.54 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.686 -177.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 141' ' ' MET . 40.4 pt -66.32 -31.19 52.5 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.141 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 91.2 mtt180 -68.97 -53.15 22.3 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 118.423 -1.311 . . . . 0.0 108.883 177.014 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 47.6 t -60.67 -54.96 38.92 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.403 -177.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -82.4 -41.49 19.85 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 -178.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.526 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 9.4 tt . . . . . 0 C--N 1.3 -1.572 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -166.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 9.9 ptpt . . . . . 0 N--CA 1.429 -1.485 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.57 -20.16 1.55 Allowed Glycine 0 N--CA 1.484 1.85 0 N-CA-C 117.121 1.608 . . . . 0.0 117.121 -170.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.435 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 67.2 p-90 -67.84 -16.51 64.13 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 117.462 0.631 . . . . 0.0 111.798 179.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -67.72 -9.91 47.86 Favored 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -89.47 -8.05 53.72 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.417 0.627 . . . . 0.0 109.663 176.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -100.04 3.08 43.92 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.634 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.0 p -135.27 113.82 15.97 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.997 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 -177.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 m -96.28 163.75 12.95 Favored 'General case' 0 N--CA 1.419 -2.01 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -176.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.16 -36.43 40.95 Favored 'General case' 0 C--O 1.213 -0.827 0 C-N-CA 124.325 1.05 . . . . 0.0 111.498 179.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -55.42 -44.81 76.59 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 123.257 0.623 . . . . 0.0 111.807 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.476 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.0 tm? -70.23 -51.14 33.03 Favored 'General case' 0 CA--C 1.492 -1.281 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -175.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.547 ' O ' HG21 ' A' ' 19' ' ' VAL . 4.6 ptm180 -65.52 -40.99 93.59 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 114.505 -1.225 . . . . 0.0 113.091 -175.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.2 t -68.18 -28.33 67.18 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -66.5 -43.0 86.53 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.49 HD23 HD22 ' A' ' 68' ' ' LEU . 5.1 mp -67.38 -40.61 85.7 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.033 177.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.547 HG21 ' O ' ' A' ' 15' ' ' ARG . 65.2 t -57.6 -49.21 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.7 0.8 . . . . 0.0 110.095 175.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -54.49 -45.1 73.17 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.309 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.4 mttm -68.55 -38.32 80.68 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.315 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.506 ' O ' HG21 ' A' ' 26' ' ' ILE . 65.8 mt -54.07 -46.58 72.05 Favored 'General case' 0 C--O 1.214 -0.787 0 O-C-N 123.661 0.601 . . . . 0.0 109.589 174.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.425 HG13 ' HE3' ' A' ' 40' ' ' MET . 46.8 t -55.28 -53.43 35.29 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.559 0 O-C-N 124.003 0.815 . . . . 0.0 110.833 174.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -57.32 -30.69 64.99 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.465 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -82.77 -46.91 12.54 Favored 'General case' 0 C--O 1.203 -1.372 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 174.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.506 HG21 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.32 -26.57 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 121.799 0.809 . . . . 0.0 110.068 -174.819 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -131.53 91.89 33.11 Favored Pre-proline 0 N--CA 1.405 -2.721 0 C-N-CA 124.438 1.095 . . . . 0.0 108.594 176.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -63.64 93.3 0.17 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.725 1.617 . . . . 0.0 109.202 176.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.8 t -65.82 130.05 94.41 Favored Pre-proline 0 N--CA 1.415 -2.18 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.567 -172.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.474 ' HG2' ' OD1' ' A' ' 31' ' ' ASP . 41.8 Cg_endo -73.64 -31.63 8.46 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.588 2.192 . . . . 0.0 111.085 178.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.474 ' OD1' ' HG2' ' A' ' 30' ' ' PRO . 6.3 p-10 -144.18 155.4 58.24 Favored Pre-proline 0 N--CA 1.427 -1.622 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.429 -175.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.453 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 72.5 Cg_endo -75.66 -5.23 16.26 Favored 'Trans proline' 0 N--CA 1.45 -1.068 0 C-N-CA 121.77 1.647 . . . . 0.0 113.351 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -88.54 -24.68 22.84 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.542 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.93 -21.09 63.07 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 122.038 0.923 . . . . 0.0 109.831 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.453 ' CD1' ' HA ' ' A' ' 32' ' ' PRO . 45.2 mt -80.05 -8.44 59.37 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.24 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -134.2 21.93 3.76 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.215 0.531 . . . . 0.0 109.927 178.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.404 ' O ' ' HB3' ' A' ' 40' ' ' MET . 20.5 t70 -90.11 178.02 6.29 Favored 'General case' 0 N--CA 1.422 -1.862 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.802 ' HD2' ' N ' ' A' ' 39' ' ' ARG . 2.3 ppt_? -63.75 -28.9 70.2 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.802 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 4.5 tpm_? -70.18 -30.19 67.25 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.032 -175.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.711 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 6.7 tpp -57.72 -32.17 67.15 Favored 'General case' 0 C--O 1.201 -1.452 0 CA-C-N 114.231 -1.35 . . . . 0.0 112.086 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.592 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -61.42 -29.83 70.18 Favored 'General case' 0 C--O 1.18 -2.594 0 C-N-CA 118.111 -1.436 . . . . 0.0 110.918 -179.445 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -75.48 -46.66 31.14 Favored 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 124.024 0.828 . . . . 0.0 109.088 176.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.584 HD11 ' O ' ' A' ' 39' ' ' ARG . 5.2 mp -51.63 -56.94 10.72 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 114.299 -1.319 . . . . 0.0 109.894 179.275 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.711 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -73.29 -28.2 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.59 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.517 -177.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.592 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -61.53 -43.24 99.22 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.525 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.9 t80 -65.81 -47.08 76.26 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.61 174.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.44 -40.91 88.32 Favored 'General case' 0 C--O 1.2 -1.51 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.829 -176.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 91.4 mttt -67.7 -43.07 80.94 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.612 0.765 . . . . 0.0 111.997 178.251 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.525 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 57.0 pttt -67.04 -40.25 87.12 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.399 0.619 . . . . 0.0 109.708 -178.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.438 HG22 ' CE2' ' A' ' 46' ' ' TYR . 45.7 t -71.53 -47.26 59.23 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.668 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.7 tm-20 -57.73 -45.65 85.52 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.189 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.91 -44.39 94.45 Favored Glycine 0 N--CA 1.436 -1.349 0 O-C-N 124.236 0.96 . . . . 0.0 111.768 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -58.72 -54.19 49.86 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.48 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -65.26 -35.21 80.31 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 178.768 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -62.91 -50.88 69.1 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.644 0.735 . . . . 0.0 109.34 177.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.78 -21.75 61.68 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.163 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.7 t -85.28 -42.8 14.3 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -178.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.05 163.52 14.63 Favored 'General case' 0 C--O 1.244 0.797 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -109.05 2.82 21.46 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.583 -178.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.7 m -161.44 154.29 20.69 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 176.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.58 -34.53 74.28 Favored 'General case' 0 C--O 1.196 -1.757 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.184 -178.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -65.12 -35.83 82.36 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -66.82 -47.84 70.78 Favored 'General case' 0 N--CA 1.455 -0.175 0 O-C-N 123.487 0.492 . . . . 0.0 110.564 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -45.1 89.94 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.252 -177.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -60.65 -46.01 91.92 Favored 'General case' 0 C--O 1.19 -2.063 0 O-C-N 123.978 0.799 . . . . 0.0 109.719 176.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.477 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 28.7 t-80 -60.05 -55.05 38.7 Favored 'General case' 0 C--O 1.208 -1.104 0 O-C-N 123.194 0.309 . . . . 0.0 111.581 -178.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.1 pp -65.74 -32.55 74.16 Favored 'General case' 0 C--O 1.262 1.746 0 CA-C-O 120.965 0.412 . . . . 0.0 111.47 -175.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.49 HD22 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -75.09 -35.83 61.75 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.362 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.477 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -63.11 -34.84 78.47 Favored 'General case' 0 C--O 1.203 -1.347 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.736 176.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 17.2 mt-10 -69.43 -42.53 74.86 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.467 178.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.9 -38.82 83.47 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.393 -0.923 . . . . 0.0 110.891 179.231 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.572 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 5.9 tt -66.2 -48.37 81.48 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.853 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.548 177.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.457 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 8.3 t80 -51.71 -51.39 56.4 Favored 'General case' 0 C--O 1.269 2.116 0 C-N-CA 124.949 1.3 . . . . 0.0 111.837 178.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.523 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.8 ptpt -65.03 -38.8 92.06 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.884 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.42 -37.06 79.03 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.654 0 O-C-N 123.557 0.536 . . . . 0.0 111.124 178.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.651 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.2 mm-40 -59.65 -55.38 35.17 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 122.085 0.945 . . . . 0.0 109.454 178.479 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 1.2 ptpm? -70.19 -27.66 64.68 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.572 178.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.523 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 6.3 tp10 -63.67 -45.84 88.28 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 176.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.651 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.7 pp -64.79 -44.83 88.7 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.874 -177.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.459 ' N ' HD13 ' A' ' 79' ' ' LEU . 7.1 pt-20 -68.67 -44.63 73.65 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 119.364 -0.934 . . . . 0.0 112.65 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.6 -40.06 95.73 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.421 -0.511 . . . . 0.0 110.813 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.66 -29.83 62.56 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.403 -178.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.035 -179.519 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.475 HD23 ' HB3' ' A' ' 79' ' ' LEU . 47.7 tp . . . . . 0 C--O 1.222 -0.368 0 CA-C-O 121.172 0.511 . . . . 0.0 110.128 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 46.4 tp -69.58 -37.72 77.09 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 18.2 m -63.56 -41.35 98.41 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 14.3 m -63.94 -46.67 83.69 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.417 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 16.2 t70 . . . . . 0 C--N 1.315 -0.919 0 C-N-CA 125.117 1.367 . . . . 0.0 111.135 -177.988 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.471 ' HB2' ' HB ' ' B' ' 145' ' ' ILE . 64.0 mtm . . . . . 0 N--CA 1.435 -1.202 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 29.4 -86.54 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 127.684 2.394 . . . . 0.0 114.432 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.53 -46.95 62.64 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.966 -172.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 47.3 mm -64.42 -47.97 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-N 114.161 -1.381 . . . . 0.0 109.167 -177.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.471 ' HB ' ' HB2' ' B' ' 141' ' ' MET . 15.6 tt -70.01 -31.57 48.26 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.403 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.616 -176.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 27.6 ttm-85 -64.73 -60.6 2.92 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 19.3 p -66.78 -44.04 82.37 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -174.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -80.57 -38.83 28.79 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.461 ' HB3' ' O ' ' B' ' 145' ' ' ILE 0.267 9.1 tt . . . . . 0 C--N 1.315 -0.892 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -173.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.3 mttp . . . . . 0 N--CA 1.42 -1.975 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.445 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -67.03 -3.92 25.56 Favored Glycine 0 C--N 1.31 -0.889 0 CA-C-N 115.838 -0.619 . . . . 0.0 114.263 -174.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 61.1 p-90 -78.76 -11.84 60.0 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 122.275 -0.544 . . . . 0.0 111.108 177.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -59.07 -26.56 64.73 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-O 121.267 0.556 . . . . 0.0 111.233 -178.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 12.9 pt-20 -81.89 -4.11 55.77 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -176.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -104.52 2.78 31.24 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 120.973 0.416 . . . . 0.0 111.555 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.61 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 1.5 t -110.5 110.54 32.55 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.459 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.507 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER -68.9 151.55 46.42 Favored 'General case' 0 N--CA 1.412 -2.373 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -179.15 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -55.03 -41.65 71.62 Favored 'General case' 0 N--CA 1.426 -1.627 0 O-C-N 124.672 1.232 . . . . 0.0 108.796 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 10.9 m-20 -67.45 -30.52 70.28 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-O 118.866 -0.587 . . . . 0.0 112.534 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.519 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.4 tm? -73.68 -54.65 7.62 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 11' ' ' THR . 1.6 ptm180 -55.14 -48.2 74.02 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 177.027 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 m -72.61 -21.13 61.17 Favored 'General case' 0 N--CA 1.426 -1.664 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.481 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 10.5 t60 -67.89 -42.43 81.22 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 174.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.519 HD11 ' O ' ' A' ' 14' ' ' LEU . 3.9 mp -69.84 -40.08 76.05 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.794 178.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.2 t -55.8 -49.72 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 C-N-CA 123.559 0.744 . . . . 0.0 109.942 172.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -53.15 -50.38 64.66 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.264 1.026 . . . . 0.0 110.122 178.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -66.73 -38.14 86.08 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.046 179.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.505 ' O ' HG23 ' A' ' 26' ' ' ILE . 3.2 mt -51.02 -50.79 57.87 Favored 'General case' 0 CA--C 1.495 -1.152 0 O-C-N 123.924 0.765 . . . . 0.0 109.61 174.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.441 HG13 ' HE1' ' A' ' 40' ' ' MET . 57.8 t -55.56 -52.78 43.56 Favored 'Isoleucine or valine' 0 C--O 1.172 -2.999 0 O-C-N 124.336 1.023 . . . . 0.0 109.771 175.155 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -54.09 -33.29 57.21 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -175.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.01 -46.23 14.24 Favored 'General case' 0 C--O 1.207 -1.175 0 CA-C-O 121.505 0.669 . . . . 0.0 111.597 175.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.567 HG22 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -78.55 -23.69 13.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 CA-C-O 122.065 0.936 . . . . 0.0 110.84 -174.082 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.567 ' CD2' HG22 ' A' ' 26' ' ' ILE . 66.1 m-85 -135.31 95.26 14.86 Favored Pre-proline 0 C--N 1.279 -2.47 0 C-N-CA 125.057 1.343 . . . . 0.0 107.491 178.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -60.53 95.29 0.11 Allowed 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.287 1.992 . . . . 0.0 112.47 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.0 t -75.27 124.62 89.29 Favored Pre-proline 0 N--CA 1.424 -1.74 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.058 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.39 -29.36 13.85 Favored 'Trans proline' 0 C--O 1.245 0.869 0 C-N-CA 122.402 2.068 . . . . 0.0 111.752 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -141.54 151.72 61.39 Favored Pre-proline 0 CA--C 1.486 -1.496 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -176.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.411 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 38.1 Cg_endo -71.67 -7.35 21.0 Favored 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 121.587 1.525 . . . . 0.0 111.611 175.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.9 -12.9 43.39 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-O 121.318 0.58 . . . . 0.0 110.69 177.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.53 -6.09 54.48 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 122.159 0.98 . . . . 0.0 108.722 175.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.568 ' O ' ' HG2' ' A' ' 40' ' ' MET . 27.6 mt -91.75 6.53 45.59 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.797 -179.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -133.07 21.91 4.12 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.593 ' OD1' ' HD3' ' A' ' 38' ' ' ARG . 13.9 t70 -85.16 170.26 13.06 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.695 -1.593 . . . . 0.0 108.449 -178.121 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.593 ' HD3' ' OD1' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.63 -24.74 61.93 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.939 0.876 . . . . 0.0 110.567 178.747 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.602 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 40.3 ttp180 -75.02 -21.2 59.23 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.818 -1.083 . . . . 0.0 109.109 178.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.756 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.2 tpp -60.67 -34.26 74.05 Favored 'General case' 0 C--O 1.207 -1.155 0 CA-C-N 115.124 -0.943 . . . . 0.0 112.413 -179.189 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.504 ' O ' ' HB1' ' A' ' 45' ' ' ALA . 0.5 OUTLIER -62.36 -31.24 71.86 Favored 'General case' 0 C--O 1.197 -1.689 0 C-N-CA 117.748 -1.581 . . . . 0.0 110.711 -178.87 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -74.31 -46.49 40.7 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 121.393 0.616 . . . . 0.0 109.712 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.3 mt -59.78 -49.63 76.97 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.578 -179.052 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.756 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.6 p -73.3 -27.68 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.577 -178.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.504 ' HB1' ' O ' ' A' ' 41' ' ' GLU . . . -59.31 -47.06 86.83 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 177.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.52 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 16.6 t80 -62.91 -45.69 91.34 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.068 174.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.66 94.12 Favored 'General case' 0 C--O 1.203 -1.352 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.216 -177.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -62.85 -44.79 95.19 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 123.29 0.636 . . . . 0.0 111.327 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.52 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 53.9 pttt -66.64 -36.49 82.7 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.645 0.736 . . . . 0.0 110.702 -177.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.498 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 69.4 t -75.23 -42.68 44.18 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.668 178.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.77 -43.3 90.33 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.23 -43.44 98.46 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.502 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.401 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 21.3 t70 -53.93 -51.97 62.08 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.257 0.623 . . . . 0.0 111.373 178.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.44 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -74.28 -27.6 60.81 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 179.66 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -63.86 -49.86 71.08 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 176.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -73.18 -22.63 60.44 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.979 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.3 t -81.37 -13.6 58.14 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.136 178.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.26 169.58 9.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.532 0.682 . . . . 0.0 112.487 -178.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -119.13 6.38 11.27 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.468 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.9 m -164.94 147.37 8.2 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.61 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -55.87 -40.39 72.87 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 175.343 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -56.17 -46.13 79.44 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.229 0.537 . . . . 0.0 110.139 178.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.65 -46.42 82.59 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.153 178.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -44.06 92.95 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 123.366 0.416 . . . . 0.0 109.994 -177.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -59.83 -47.58 85.15 Favored 'General case' 0 C--O 1.201 -1.45 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.631 175.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -62.31 -48.42 79.95 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -177.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.401 HD13 ' CB ' ' A' ' 54' ' ' MET . 3.9 pp -71.97 -30.69 65.53 Favored 'General case' 0 C--O 1.258 1.507 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.273 -175.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.461 HD22 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -75.77 -33.6 60.2 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.507 ' HB3' ' HA ' ' B' ' 149' ' ' LEU . . . -62.07 -40.12 94.72 Favored 'General case' 0 C--O 1.198 -1.607 0 CA-C-N 115.03 -0.986 . . . . 0.0 108.781 176.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.87 -46.46 87.76 Favored 'General case' 0 C--O 1.259 1.58 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.932 177.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.77 -40.82 88.35 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.168 179.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.525 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 7.8 tt -67.08 -44.76 87.93 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.228 -178.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -52.64 -49.5 65.03 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 125.869 1.668 . . . . 0.0 111.215 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 16.6 ptpt -69.18 -33.26 73.1 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.442 -179.324 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.45 HD11 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -66.28 -39.28 83.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 116.772 -0.194 . . . . 0.0 110.707 175.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.568 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 22.5 mm-40 -58.62 -48.54 80.66 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.306 0.575 . . . . 0.0 109.491 178.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.715 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS 0.252 0.0 OUTLIER -69.5 -33.35 72.72 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 175.917 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -59.37 -45.92 90.1 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 176.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.4 pp -67.36 -39.71 85.73 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.459 -179.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 14.6 pt-20 -63.74 -45.16 91.16 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.04 0.382 . . . . 0.0 110.457 -178.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.7 pt-20 -76.01 -37.8 58.02 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -33.34 72.92 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.034 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 28.9 tpt180 . . . . . 0 N--CA 1.467 0.421 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.312 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.456 HD21 ' HB3' ' A' ' 79' ' ' LEU . 48.8 tp . . . . . 0 C--O 1.216 -0.67 0 CA-C-O 120.765 0.317 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.16 -42.34 66.02 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 175.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 30.7 m -68.83 -35.59 77.16 Favored 'General case' 0 CA--C 1.553 1.059 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.216 178.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 29.8 m -74.48 -26.64 60.14 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-O 121.36 0.6 . . . . 0.0 110.876 177.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.412 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 15.1 t70 . . . . . 0 C--N 1.321 -0.634 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 141' ' ' MET . . . . . 0.502 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 53.4 ttp . . . . . 0 C--O 1.206 -1.203 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -46.51 -58.09 4.1 Favored 'General case' 0 CA--C 1.568 1.646 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 -171.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 10.0 m -65.43 -39.57 92.26 Favored 'General case' 0 C--O 1.264 1.861 0 CA-C-O 121.922 0.868 . . . . 0.0 110.387 -176.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 47.1 mm -67.45 -44.87 86.53 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.133 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.365 -179.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.502 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 18.3 tt -67.82 -31.13 50.88 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-O 120.832 0.349 . . . . 0.0 111.494 -176.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -65.31 0.71 Allowed 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.062 171.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.7 p -61.1 -43.11 99.38 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -174.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -81.32 -46.69 14.35 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.507 ' HA ' ' HB3' ' A' ' 69' ' ' ALA 0.279 8.2 tt . . . . . 0 C--N 1.317 -0.829 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -169.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 82.9 mttt . . . . . 0 N--CA 1.428 -1.557 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.58 -22.38 39.01 Favored Glycine 0 N--CA 1.464 0.56 0 O-C-N 123.904 0.752 . . . . 0.0 114.892 -173.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -74.97 -5.02 41.66 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 122.216 -0.579 . . . . 0.0 112.173 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -61.04 -26.59 67.73 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 117.98 0.354 . . . . 0.0 110.941 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -78.13 -7.05 56.52 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.595 0.712 . . . . 0.0 110.368 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 -102.35 3.14 37.65 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.817 -177.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.0 p -136.52 109.55 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.843 0 CA-C-O 122.157 0.98 . . . . 0.0 108.839 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.5 m -86.37 155.76 20.47 Favored 'General case' 0 C--N 1.286 -2.162 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.376 -175.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.71 -39.47 51.61 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.409 1.084 . . . . 0.0 110.928 177.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -57.43 -41.11 79.8 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 178.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.532 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.1 tm? -69.02 -52.31 30.0 Favored 'General case' 0 CA--C 1.485 -1.543 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -175.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.592 ' O ' HG22 ' A' ' 19' ' ' VAL . 4.8 ptm180 -64.5 -44.67 90.22 Favored 'General case' 0 N--CA 1.413 -2.299 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.985 -176.156 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 t -64.21 -29.93 71.01 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.946 0.403 . . . . 0.0 110.038 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -66.18 -45.57 80.39 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.532 HD11 ' O ' ' A' ' 14' ' ' LEU . 4.9 mp -66.24 -39.42 89.52 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.739 177.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.592 HG22 ' O ' ' A' ' 15' ' ' ARG . 62.2 t -58.15 -50.18 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 124.329 1.052 . . . . 0.0 110.361 175.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -54.8 -46.56 74.51 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.483 177.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -65.94 -38.83 89.65 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.848 177.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.519 ' O ' HG22 ' A' ' 26' ' ' ILE . 20.7 mt -52.09 -49.31 63.84 Favored 'General case' 0 CA--C 1.498 -1.033 0 O-C-N 123.859 0.724 . . . . 0.0 110.023 174.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 71.2 t -56.62 -52.36 54.64 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.677 0 O-C-N 124.139 0.899 . . . . 0.0 109.825 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -53.58 -34.5 58.58 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -178.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.5 -45.9 15.3 Favored 'General case' 0 C--O 1.2 -1.539 0 CA-C-O 121.152 0.501 . . . . 0.0 111.917 176.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.526 HG13 ' CZ ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -75.31 -32.94 26.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-O 121.365 0.602 . . . . 0.0 110.679 -175.05 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.481 ' CD2' HG21 ' A' ' 26' ' ' ILE . 56.4 m-85 -128.56 91.57 43.22 Favored Pre-proline 0 C--N 1.283 -2.284 0 C-N-CA 124.801 1.24 . . . . 0.0 108.256 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.21 96.55 0.34 Allowed 'Trans proline' 0 N--CA 1.447 -1.224 0 C-N-CA 121.51 1.473 . . . . 0.0 110.062 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.8 t -52.64 123.56 31.1 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.879 -176.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.88 -16.88 29.28 Favored 'Trans proline' 0 C--O 1.237 0.451 0 C-N-CA 122.389 2.059 . . . . 0.0 112.27 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -163.39 148.54 9.26 Favored Pre-proline 0 N--CA 1.446 -0.638 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -174.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.413 ' O ' HD12 ' A' ' 35' ' ' LEU . 4.8 Cg_endo -52.57 -27.59 33.3 Favored 'Trans proline' 0 CA--C 1.559 1.749 0 C-N-CA 123.34 2.694 . . . . 0.0 113.172 173.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.63 -11.61 57.05 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 121.133 -0.98 . . . . 0.0 111.813 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.44 -42.1 30.93 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.085 0.469 . . . . 0.0 110.692 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 32' ' ' PRO 0.326 0.3 OUTLIER -75.84 8.51 3.02 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 178.039 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -133.06 17.97 4.11 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.408 0.623 . . . . 0.0 110.263 174.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.567 ' O ' ' HB3' ' A' ' 40' ' ' MET . 36.6 t70 -93.21 -178.38 4.75 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.721 -178.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.509 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.91 -22.45 62.25 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.916 -0.49 . . . . 0.0 110.46 179.246 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.555 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 42.3 ttm180 -73.27 -21.9 60.5 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.516 0.674 . . . . 0.0 109.716 176.176 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.647 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.4 tpp -61.55 -34.53 75.72 Favored 'General case' 0 C--O 1.197 -1.704 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.869 177.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.48 ' O ' ' HB1' ' A' ' 45' ' ' ALA . 12.9 pt-20 -66.97 -24.86 66.1 Favored 'General case' 0 C--O 1.2 -1.531 0 C-N-CA 118.33 -1.348 . . . . 0.0 110.844 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -74.28 -44.58 52.18 Favored 'General case' 0 C--O 1.249 1.063 0 CA-C-O 121.485 0.659 . . . . 0.0 109.548 174.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.4 mt -63.08 -49.12 75.75 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.504 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.647 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 2.6 p -70.58 -27.89 32.7 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.337 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.685 -178.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.48 ' HB1' ' O ' ' A' ' 41' ' ' GLU . . . -60.55 -44.31 96.28 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 176.257 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.526 ' CZ ' HG13 ' A' ' 26' ' ' ILE . 5.1 t80 -60.79 -47.76 84.85 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 173.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.81 -43.41 94.53 Favored 'General case' 0 C--O 1.197 -1.709 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.999 -176.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -64.0 -42.39 97.17 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 123.525 0.73 . . . . 0.0 112.06 177.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.4 pttp -68.01 -37.09 81.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.489 0.661 . . . . 0.0 110.056 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.478 HG23 ' CZ ' ' A' ' 46' ' ' TYR . 52.9 t -73.06 -49.41 38.93 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.576 178.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 13.8 tm-20 -56.62 -46.07 81.16 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 124.112 0.965 . . . . 0.0 109.202 178.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.419 ' O ' ' HG2' ' A' ' 56' ' ' GLU . . . -58.01 -48.19 84.24 Favored Glycine 0 N--CA 1.432 -1.609 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.88 178.307 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -56.71 -51.16 69.87 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.118 0.485 . . . . 0.0 111.781 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.412 ' HE3' ' HB3' ' A' ' 54' ' ' MET . 0.3 OUTLIER -67.99 -29.62 68.68 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 179.139 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.416 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 65.6 t80 -62.75 -51.52 66.83 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 176.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 52' ' ' GLY . 5.9 mm-40 -71.95 -24.48 61.62 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.691 -177.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 t -79.55 -22.05 44.33 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.312 0.577 . . . . 0.0 110.183 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -93.15 162.81 13.87 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 121.157 0.504 . . . . 0.0 111.171 -177.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -118.51 19.01 13.45 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.647 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.5 p -167.21 157.2 10.98 Favored 'General case' 0 CA--C 1.488 -1.441 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 171.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.29 -26.1 61.84 Favored 'General case' 0 C--N 1.308 -1.196 0 C-N-CA 119.241 -0.984 . . . . 0.0 111.432 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -65.53 -47.37 76.15 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.87 -47.31 86.27 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.865 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.19 -46.63 79.97 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.963 -176.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.493 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 2.4 t80 -60.99 -43.43 98.88 Favored 'General case' 0 C--O 1.203 -1.351 0 O-C-N 123.8 0.687 . . . . 0.0 110.301 178.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 31.8 t-80 -62.88 -54.66 35.24 Favored 'General case' 0 C--O 1.214 -0.789 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.412 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.1 pp -65.39 -33.64 76.43 Favored 'General case' 0 C--O 1.272 2.286 0 CA-C-O 121.413 0.625 . . . . 0.0 111.634 -175.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.499 HD21 HD22 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -73.79 -35.29 64.9 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.236 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.434 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -63.78 -34.49 78.02 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.159 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -68.44 -46.76 69.0 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 120.134 -0.626 . . . . 0.0 110.055 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -64.73 -36.83 85.55 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 119.501 -0.88 . . . . 0.0 111.512 -179.038 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.523 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 8.9 tt -69.31 -47.07 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.576 179.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.485 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 23.0 t80 -51.68 -49.94 61.4 Favored 'General case' 0 C--O 1.256 1.427 0 C-N-CA 125.889 1.676 . . . . 0.0 111.063 178.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -67.35 -34.64 77.74 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.679 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.79 -34.83 66.68 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 CA-C-O 120.603 0.239 . . . . 0.0 111.086 177.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 72' ' ' ILE . 22.1 mm-40 -62.06 -49.52 75.67 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.591 ' HZ2' ' HB3' ' A' ' 77' ' ' LYS . 0.5 OUTLIER -71.92 -31.04 65.97 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 119.656 -0.818 . . . . 0.0 113.088 177.491 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -57.92 -50.35 73.65 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 175.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -64.93 -36.95 86.04 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.379 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -61.01 -53.54 56.01 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.131 0.572 . . . . 0.0 111.612 177.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -69.5 -39.8 77.4 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.854 -177.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.61 -34.23 77.76 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -178.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 . . . . . 0 N--CA 1.446 -0.627 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.904 -178.902 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.207 -1.151 0 N-CA-C 110.603 -0.147 . . . . 0.0 110.603 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.3 tp -65.37 -36.93 85.48 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 176.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 62.4 m -64.36 -46.39 83.6 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 14.7 m -67.03 -34.69 78.25 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.974 178.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.8 t70 . . . . . 0 C--N 1.319 -0.74 0 C-N-CA 123.901 0.881 . . . . 0.0 108.85 179.268 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 17.8 ptm . . . . . 0 C--O 1.181 -2.544 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -26.92 -61.1 0.09 Allowed 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -167.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 28.5 m -71.27 -38.19 71.88 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.834 -0.541 . . . . 0.0 111.671 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 48.0 mm -68.68 -47.56 75.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.493 ' HA ' ' OH ' ' A' ' 65' ' ' TYR . 7.9 tp -61.75 -39.07 82.01 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.307 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 41.3 ttt180 -65.35 -49.5 69.11 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 118.573 -1.251 . . . . 0.0 110.82 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 28.9 m -66.08 -44.84 83.28 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.0 -40.28 39.57 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 121.076 -0.249 . . . . 0.0 111.586 -175.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.457 HD12 HD13 ' A' ' 72' ' ' ILE . 2.8 tm? . . . . . 0 C--N 1.313 -0.987 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.358 -173.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.601 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.2 ptpt . . . . . 0 N--CA 1.421 -1.883 0 CA-C-O 121.821 0.819 . . . . 0.0 110.175 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.02 -8.4 8.33 Favored Glycine 0 C--O 1.243 0.669 0 CA-C-N 114.29 -1.323 . . . . 0.0 115.471 -173.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.601 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 59.7 p-90 -62.48 -16.25 54.4 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 117.129 0.465 . . . . 0.0 111.405 177.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . 0.434 ' HB2' ' HH ' ' A' ' 55' ' ' TYR . 9.7 p80 -59.97 -11.84 6.6 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 178.294 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -89.82 -8.31 52.35 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.034 0.445 . . . . 0.0 110.336 178.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -107.6 13.61 26.51 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.628 0.728 . . . . 0.0 111.042 -174.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.3 p -134.14 110.52 13.86 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.205 0 CA-C-O 122.156 0.979 . . . . 0.0 108.598 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.9 m -81.16 154.35 26.76 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.197 -173.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.49 -34.84 73.08 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.415 178.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.98 -39.21 81.05 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.941 176.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.519 ' O ' HD12 ' A' ' 18' ' ' LEU . 2.9 tm? -69.67 -52.43 25.82 Favored 'General case' 0 CA--C 1.493 -1.247 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 -177.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.564 ' O ' HG21 ' A' ' 19' ' ' VAL . 6.2 ptm180 -65.1 -44.17 89.7 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.882 -175.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.0 t -66.52 -27.13 67.52 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 24.9 t60 -67.62 -46.31 72.87 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 14' ' ' LEU . 5.1 mp -63.89 -38.99 93.13 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.698 177.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.564 HG21 ' O ' ' A' ' 15' ' ' ARG . 75.6 t -58.19 -48.38 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 123.644 0.778 . . . . 0.0 109.972 174.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.522 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 18.5 t-80 -55.37 -45.85 76.5 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.445 0.698 . . . . 0.0 110.351 177.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.1 mttp -65.67 -38.65 89.87 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.87 178.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.99 -44.65 82.91 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.522 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 25.1 t -53.73 -49.36 57.91 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.906 0 C-N-CA 124.055 0.942 . . . . 0.0 110.931 172.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -69.61 -25.86 64.16 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.029 -0.668 . . . . 0.0 112.58 -176.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.427 ' O ' HD11 ' B' ' 114' ' ' LEU . . . -78.83 -42.18 28.3 Favored 'General case' 0 C--O 1.196 -1.732 0 C-N-CA 120.971 -0.292 . . . . 0.0 110.747 174.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.9 tt -70.68 -38.82 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 119.902 -0.719 . . . . 0.0 111.194 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -125.52 99.09 33.61 Favored Pre-proline 0 N--CA 1.415 -2.192 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -175.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.43 97.84 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 121.735 1.623 . . . . 0.0 108.815 170.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.0 t -75.8 136.68 70.24 Favored Pre-proline 0 N--CA 1.426 -1.664 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.624 -176.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.48 -21.3 11.68 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 122.498 2.132 . . . . 0.0 111.677 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -158.31 141.93 11.11 Favored Pre-proline 0 CA--C 1.496 -1.133 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -176.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -55.49 -20.04 25.16 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.913 2.409 . . . . 0.0 114.61 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.9 -10.04 59.41 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 121.171 -0.956 . . . . 0.0 112.03 179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -6.56 55.24 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.179 0.99 . . . . 0.0 108.828 174.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.511 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.4 mt -90.94 5.65 47.85 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.22 -179.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.485 ' HB3' ' HZ1' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -133.13 26.96 4.21 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 176.1 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.562 ' O ' ' HB3' ' A' ' 40' ' ' MET . 22.7 t70 -92.29 173.08 8.0 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.627 -1.169 . . . . 0.0 109.424 -177.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.527 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.26 -25.94 62.68 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.209 0.528 . . . . 0.0 110.324 177.811 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.488 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 33.7 ttm180 -72.19 -27.43 62.55 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-O 121.589 0.709 . . . . 0.0 109.951 176.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.626 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 4.8 tpp -57.25 -37.41 72.26 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.242 178.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.535 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 11.6 pt-20 -61.44 -29.08 69.72 Favored 'General case' 0 C--O 1.202 -1.407 0 C-N-CA 119.023 -1.071 . . . . 0.0 110.245 -179.219 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.488 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.3 t30 -69.68 -48.63 59.03 Favored 'General case' 0 C--O 1.253 1.25 0 C-N-CA 122.849 0.46 . . . . 0.0 109.993 175.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.477 HD21 ' O ' ' A' ' 39' ' ' ARG . 2.7 mm? -61.97 -51.61 67.37 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.274 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.626 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -67.77 -29.21 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.832 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.082 -176.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -60.74 -45.96 92.27 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.097 0.475 . . . . 0.0 109.865 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.498 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 1.7 t80 -62.38 -46.86 86.72 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.622 174.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.81 91.54 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.092 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -64.75 -44.28 90.59 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 123.742 0.817 . . . . 0.0 112.487 177.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.7 pttp -64.77 -39.94 94.44 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-O 121.489 0.661 . . . . 0.0 109.532 -178.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.1 t -67.68 -53.24 32.84 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.978 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -55.4 -48.33 74.52 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 124.036 0.934 . . . . 0.0 110.02 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.37 -37.79 94.65 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.486 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -64.52 -47.76 77.64 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 121.398 0.618 . . . . 0.0 110.718 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.404 ' CB ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -70.28 -29.49 66.27 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 121.817 -0.552 . . . . 0.0 112.11 176.688 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.434 ' HH ' ' HB2' ' A' ' 7' ' ' HIS . 62.6 t80 -62.9 -54.7 34.54 Favored 'General case' 0 C--O 1.193 -1.873 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 177.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -68.99 -27.2 65.48 Favored 'General case' 0 C--N 1.307 -1.252 0 O-C-N 122.027 -0.421 . . . . 0.0 111.563 -177.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.2 t -74.34 -32.97 62.99 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 123.504 0.721 . . . . 0.0 112.455 -178.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.03 159.92 30.33 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -174.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -98.93 -1.98 38.65 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.171 178.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' SER . . . . . 0.447 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 66.4 p -168.17 158.0 9.84 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.529 174.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -35.62 80.05 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -67.57 -33.67 75.5 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -70.75 -44.76 66.09 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.683 175.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -45.8 89.14 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.455 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 1.3 t80 -60.74 -46.59 89.83 Favored 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.031 176.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -59.18 -52.04 67.42 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.404 HD13 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -67.88 -37.63 82.02 Favored 'General case' 0 C--O 1.267 2.016 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.944 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.497 HD21 HD22 ' A' ' 18' ' ' LEU . 1.5 pp -68.9 -36.62 78.26 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.481 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -64.02 -41.21 97.52 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.607 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -62.77 -46.42 88.11 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.542 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -38.07 69.94 Favored 'General case' 0 N--CA 1.438 -1.047 0 C-N-CA 118.935 -1.106 . . . . 0.0 112.14 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.499 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 4.2 tt -65.26 -45.83 92.46 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.15 178.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.484 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 17.8 t80 -53.29 -53.34 52.37 Favored 'General case' 0 C--O 1.272 2.259 0 C-N-CA 125.37 1.468 . . . . 0.0 111.409 178.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.497 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.3 ptpt -63.72 -34.22 77.39 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.756 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.78 -40.78 84.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 O-C-N 123.5 0.5 . . . . 0.0 111.913 177.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.581 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.4 mm-40 -57.96 -53.59 56.57 Favored 'General case' 0 C--O 1.253 1.239 0 CA-C-O 121.967 0.889 . . . . 0.0 109.554 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.546 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 12.2 ptpt -70.3 -32.53 70.35 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 118.977 -1.089 . . . . 0.0 112.888 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 18.6 tp10 -62.34 -46.35 89.07 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.2 pp -63.45 -43.27 97.86 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.042 -177.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.489 ' N ' HD11 ' A' ' 79' ' ' LEU . 7.2 pt-20 -69.38 -43.82 72.74 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 118.809 -1.156 . . . . 0.0 112.156 -178.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 13.3 pt-20 -69.98 -32.27 70.4 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 120.325 -0.55 . . . . 0.0 112.066 -178.008 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.559 ' HZ3' ' CG ' ' B' ' 118' ' ' ASP . 0.3 OUTLIER -72.93 -35.5 67.02 Favored 'General case' 0 C--O 1.215 -0.761 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.221 177.647 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.405 ' HD3' ' OD2' ' B' ' 118' ' ' ASP . 18.5 tpt180 . . . . . 0 C--O 1.234 0.276 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.149 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.427 HD11 ' O ' ' A' ' 25' ' ' ALA . 0.1 OUTLIER . . . . . 0 C--O 1.191 -2.007 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 58.9 tp -62.37 -33.35 74.57 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 121.211 0.529 . . . . 0.0 110.135 175.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 40.9 m -72.15 -43.69 64.25 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.477 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 13.5 p -73.52 -26.89 61.08 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-O 121.442 0.639 . . . . 0.0 110.909 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.559 ' CG ' ' HZ3' ' A' ' 82' ' ' LYS . 5.4 t70 . . . . . 0 C--N 1.312 -1.06 0 C-N-CA 124.456 1.102 . . . . 0.0 109.695 173.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 21.5 ptp . . . . . 0 N--CA 1.484 1.248 0 N-CA-C 117.027 2.232 . . . . 0.0 117.027 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -21.92 -64.77 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 118.717 2.858 . . . . 0.0 118.717 -165.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 19.4 p -67.65 -44.69 77.3 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.172 0.511 . . . . 0.0 111.721 -171.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 57.2 mt -66.55 -46.6 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.946 -178.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . 0.483 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 18.2 tt -67.65 -33.36 61.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -69.64 -52.45 25.77 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.642 176.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.3 m -64.85 -41.81 95.39 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -176.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -81.08 -39.89 24.99 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -177.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.483 ' HB3' ' O ' ' B' ' 145' ' ' ILE . 8.3 tt . . . . . 0 C--N 1.315 -0.927 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 -169.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.41 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 79.3 mttt . . . . . 0 N--CA 1.428 -1.557 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.31 -20.55 10.43 Favored Glycine 0 N--CA 1.466 0.648 0 N-CA-C 115.69 1.036 . . . . 0.0 115.69 -174.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.41 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 67.2 p-90 -70.39 -12.57 61.67 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 122.287 -0.537 . . . . 0.0 111.986 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -58.96 -21.2 58.05 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-O 120.92 0.391 . . . . 0.0 111.955 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -82.38 -13.48 56.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.477 0.656 . . . . 0.0 110.316 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.406 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 21.0 m-70 -94.24 2.26 55.91 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.218 -176.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.435 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.9 p -129.12 110.86 21.44 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 CA-C-O 121.416 0.627 . . . . 0.0 110.07 -177.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 m -88.72 157.19 18.6 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.928 -176.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.59 -37.32 62.85 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.841 0.856 . . . . 0.0 111.267 178.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.07 -35.36 80.01 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.543 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.2 tm? -70.49 -52.0 25.03 Favored 'General case' 0 CA--C 1.488 -1.438 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -176.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.526 ' O ' HG23 ' A' ' 19' ' ' VAL . 3.7 ptm180 -63.32 -44.62 94.43 Favored 'General case' 0 N--CA 1.42 -1.96 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.996 -178.276 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 t -61.95 -31.49 71.84 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.785 0.326 . . . . 0.0 110.445 178.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -66.66 -45.47 78.84 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.543 HD12 ' O ' ' A' ' 14' ' ' LEU . 7.0 mp -67.32 -40.84 86.01 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.221 178.365 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 15' ' ' ARG . 54.6 t -56.47 -49.96 74.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 124.306 1.043 . . . . 0.0 109.828 175.012 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -58.12 -44.12 87.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.095 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -66.6 -40.92 89.1 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.931 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.539 ' O ' HG22 ' A' ' 26' ' ' ILE . 11.7 mt -50.83 -51.12 54.19 Favored 'General case' 0 CA--C 1.5 -0.959 0 O-C-N 124.211 0.944 . . . . 0.0 109.057 173.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.455 HG13 ' CE ' ' A' ' 40' ' ' MET . 79.2 t -55.23 -52.89 40.66 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.799 0 O-C-N 124.484 1.115 . . . . 0.0 111.05 175.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -52.46 -35.83 53.38 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.89 -46.48 14.03 Favored 'General case' 0 C--O 1.2 -1.518 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 176.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.601 HG21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.5 -24.76 14.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-O 122.218 1.009 . . . . 0.0 110.499 -174.111 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.601 ' CD2' HG21 ' A' ' 26' ' ' ILE . 75.1 m-85 -131.01 86.52 51.53 Favored Pre-proline 0 C--N 1.271 -2.828 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.497 178.384 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -61.22 104.88 0.31 Allowed 'Trans proline' 0 N--CA 1.441 -1.57 0 N-CA-C 108.636 -1.332 . . . . 0.0 108.636 175.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.9 t -72.68 143.03 84.29 Favored Pre-proline 0 N--CA 1.422 -1.865 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.751 -173.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -77.94 -29.51 4.25 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.226 2.618 . . . . 0.0 111.073 175.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -137.72 135.92 19.54 Favored Pre-proline 0 CA--C 1.493 -1.215 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -176.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -63.8 -18.42 63.92 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 121.472 1.448 . . . . 0.0 111.587 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.7 -15.25 55.04 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 121.748 -0.595 . . . . 0.0 111.189 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.76 -16.21 63.27 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 121.468 0.652 . . . . 0.0 109.353 175.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.5 mt -81.02 3.4 23.21 Favored 'General case' 0 C--O 1.214 -0.809 0 CA-C-N 114.496 -1.229 . . . . 0.0 110.547 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.81 10.85 2.89 Favored 'General case' 0 C--N 1.288 -2.095 0 O-C-N 121.366 -0.834 . . . . 0.0 110.099 170.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.431 ' O ' ' HB3' ' A' ' 40' ' ' MET . 1.9 t70 -104.72 -167.3 1.33 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.202 -170.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -36.39 81.23 Favored 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 118.264 0.484 . . . . 0.0 111.632 -177.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.535 ' O ' HD13 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -64.55 -33.82 76.8 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -177.864 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.57 ' O ' HG23 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.77 -33.45 71.7 Favored 'General case' 0 C--O 1.171 -3.074 0 CA-C-O 118.435 -0.793 . . . . 0.0 111.1 -178.899 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -64.05 -34.18 77.43 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.235 0.925 . . . . 0.0 110.477 -176.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -71.81 -45.62 60.92 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.819 0.818 . . . . 0.0 109.379 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.535 HD13 ' O ' ' A' ' 39' ' ' ARG . 0.3 OUTLIER -57.01 -52.61 64.59 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 113.946 -1.479 . . . . 0.0 110.808 -179.147 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 40' ' ' MET . 27.6 m -69.97 -32.02 50.0 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.487 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.347 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.64 -48.86 74.28 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 175.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.517 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 9.7 t80 -63.92 -48.66 75.69 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.943 174.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.03 -40.66 94.43 Favored 'General case' 0 C--O 1.196 -1.752 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.498 -176.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 mttm -66.09 -42.28 89.54 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 123.676 0.79 . . . . 0.0 111.533 178.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.0 pttp -65.47 -40.65 93.4 Favored 'General case' 0 C--O 1.254 1.309 0 CA-C-O 121.443 0.639 . . . . 0.0 110.19 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.418 HG22 ' CZ ' ' A' ' 46' ' ' TYR . 78.3 t -71.56 -47.5 57.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.519 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -57.93 -47.68 82.15 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 123.53 0.732 . . . . 0.0 109.269 179.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.31 -39.46 92.65 Favored Glycine 0 CA--C 1.505 -0.551 0 O-C-N 123.673 0.608 . . . . 0.0 112.104 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.0 -54.26 48.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.034 0.445 . . . . 0.0 110.804 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.422 ' HE3' ' HB3' ' A' ' 54' ' ' MET . 0.3 OUTLIER -67.89 -29.3 68.37 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 179.019 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -61.63 -54.39 43.54 Favored 'General case' 0 C--O 1.2 -1.526 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 176.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -74.02 -22.12 59.7 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.826 -0.546 . . . . 0.0 111.815 -176.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -79.96 -21.5 43.7 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-O 120.715 0.293 . . . . 0.0 111.01 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.05 165.14 17.76 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -176.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -107.08 -0.74 22.68 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.306 177.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.9 p -162.86 159.08 23.42 Favored 'General case' 0 CA--C 1.482 -1.648 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.28 -24.73 61.39 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 119.016 -1.074 . . . . 0.0 110.344 178.531 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -63.62 -47.31 81.9 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -63.23 -47.98 80.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.785 176.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -45.7 92.66 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 123.156 0.285 . . . . 0.0 110.753 -176.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -62.2 -47.01 86.34 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.961 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.489 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 14.6 t60 -57.78 -54.59 45.12 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.408 0.443 . . . . 0.0 111.195 -178.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.404 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.5 pp -67.71 -32.11 72.52 Favored 'General case' 0 C--O 1.245 0.833 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -175.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.481 HD23 HD22 ' A' ' 18' ' ' LEU . 1.2 pp -75.65 -31.0 59.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.774 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.444 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -67.23 -34.22 77.0 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.948 176.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 10.6 mm-40 -66.8 -44.34 81.48 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.631 0.729 . . . . 0.0 109.318 176.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.443 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -66.64 -42.59 86.45 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.096 -179.059 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.444 HG21 ' HA ' ' A' ' 69' ' ' ALA . 6.0 tt -65.12 -46.61 90.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 C-N-CA 119.999 -0.681 . . . . 0.0 110.67 -178.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.69 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 59.4 t80 -50.65 -54.23 24.59 Favored 'General case' 0 C--O 1.268 2.043 0 C-N-CA 125.808 1.643 . . . . 0.0 110.764 177.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.5 ptpt -63.74 -31.66 72.9 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.705 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.76 -37.57 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.475 177.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . 0.533 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 31.4 mt-30 -68.04 -42.04 81.16 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.832 -177.229 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.69 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.4 OUTLIER -70.24 -30.4 67.46 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 119.199 -1.001 . . . . 0.0 112.205 176.27 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.82 -45.42 89.7 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 176.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -65.95 -41.2 91.59 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 16.0 pt-20 -69.86 -41.61 74.62 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.593 -177.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 8.4 pt-20 -65.79 -44.41 85.83 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.308 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.18 -42.37 93.72 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.158 -175.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 54.4 ttp180 . . . . . 0 C--O 1.243 0.755 0 C-N-CA 120.93 -0.308 . . . . 0.0 110.89 -178.064 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 114' ' ' LEU . . . . . 0.446 HD23 ' HB3' ' A' ' 79' ' ' LEU . 40.6 tp . . . . . 0 C--O 1.188 -2.175 0 N-CA-C 111.4 0.148 . . . . 0.0 111.4 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.4 tp -69.9 -45.41 67.69 Favored 'General case' 0 C--O 1.246 0.907 0 O-C-N 121.88 -0.513 . . . . 0.0 110.412 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 35.7 m -61.56 -33.2 73.44 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.01 177.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 117' ' ' SER . . . . . 0.502 ' HB3' ' CD1' ' A' ' 27' ' ' PHE . 19.8 m -77.67 -43.49 31.07 Favored 'General case' 0 CA--C 1.56 1.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.808 176.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.432 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 6.7 t70 . . . . . 0 N--CA 1.487 1.422 0 C-N-CA 124.799 1.24 . . . . 0.0 111.339 -175.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 58.0 mtm . . . . . 0 C--O 1.188 -2.152 0 CA-C-O 118.541 -0.743 . . . . 0.0 112.834 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -25.07 -60.25 0.06 Allowed 'General case' 0 N--CA 1.51 2.559 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 -168.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 5.2 p -61.27 -43.57 98.66 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 122.238 1.018 . . . . 0.0 111.128 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 45.9 mm -70.2 -38.33 74.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.837 0 CA-C-N 114.005 -1.452 . . . . 0.0 109.73 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 18.3 mm -54.7 -49.65 66.41 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.923 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.553 175.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -58.69 -65.11 0.71 Allowed 'General case' 0 N--CA 1.43 -1.442 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.308 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 65.3 m -61.97 -54.79 36.87 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -174.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -81.47 -35.59 30.34 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -174.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 9.1 tt . . . . . 0 N--CA 1.438 -1.056 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -170.895 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.525 0 N-CA-C 109.764 -1.335 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 73.3 t 67.19 133.89 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 121.671 0.748 . . . . 0.0 111.812 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.92 108.28 11.06 Favored 'General case' 0 CA--C 1.467 -2.238 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.642 177.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 10.0 ptpp? -130.9 95.91 3.94 Favored 'General case' 0 N--CA 1.39 -3.466 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.553 177.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.25 -9.74 24.54 Favored Glycine 0 C--O 1.238 0.376 0 CA-C-N 114.391 -1.277 . . . . 0.0 115.158 -174.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.471 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 66.0 p-90 -68.55 -9.13 47.43 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 117.196 0.498 . . . . 0.0 112.067 178.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.406 ' HD2' ' O ' ' A' ' 4' ' ' LYS . 21.7 p80 -58.54 -24.09 59.84 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-O 120.918 0.389 . . . . 0.0 111.797 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.18 -10.6 59.71 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.171 0.51 . . . . 0.0 110.406 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -105.47 10.88 33.1 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.398 0.618 . . . . 0.0 110.53 -176.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.439 HG21 HD13 ' A' ' 14' ' ' LEU . 7.5 p -139.86 128.57 27.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.407 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.4 p -106.66 162.09 14.06 Favored 'General case' 0 CA--C 1.473 -1.986 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.467 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 0.8 OUTLIER -53.63 -41.58 66.86 Favored 'General case' 0 N--CA 1.422 -1.845 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.596 176.324 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.558 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 6.2 t70 -58.69 -40.85 84.82 Favored 'General case' 0 C--O 1.203 -1.394 0 O-C-N 122.951 0.157 . . . . 0.0 111.225 178.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.443 ' CD2' ' HB2' ' B' ' 137' ' ' LEU . 3.1 tm? -69.3 -50.15 49.4 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -175.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.472 ' O ' HG23 ' A' ' 19' ' ' VAL . 13.4 ptm180 -63.79 -46.15 86.5 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.623 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.7 t -67.48 -26.66 66.48 Favored 'General case' 0 CA--C 1.556 1.186 0 CA-C-O 121.033 0.444 . . . . 0.0 110.37 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.558 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 12.3 t60 -68.1 -49.41 61.33 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.494 HD21 HD21 ' A' ' 68' ' ' LEU . 1.2 mp -60.25 -49.55 77.15 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.524 176.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 15' ' ' ARG . 21.4 t -52.13 -43.3 37.82 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.765 0 C-N-CA 124.581 1.153 . . . . 0.0 109.034 177.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -58.51 -44.93 89.65 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 122.751 0.42 . . . . 0.0 110.396 177.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.537 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 2.5 mptp? -65.03 -35.57 81.58 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.576 175.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.452 ' O ' HG21 ' A' ' 26' ' ' ILE . 9.0 mp -55.5 -44.72 76.84 Favored 'General case' 0 CA--C 1.476 -1.897 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.816 176.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.49 ' HA ' HG21 ' A' ' 26' ' ' ILE . 78.6 t -58.77 -47.15 90.06 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.919 0 O-C-N 124.134 0.896 . . . . 0.0 110.688 174.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -56.86 -33.76 67.14 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.986 0.422 . . . . 0.0 111.869 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.87 -45.7 15.14 Favored 'General case' 0 C--O 1.192 -1.943 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 177.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.49 HG21 ' HA ' ' A' ' 23' ' ' VAL . 3.2 tt -71.55 -35.27 55.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 O-C-N 121.105 -0.997 . . . . 0.0 110.218 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -119.2 96.88 50.32 Favored Pre-proline 0 N--CA 1.398 -3.036 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 -179.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.97 96.68 0.1 Allowed 'Trans proline' 0 C--O 1.256 1.408 0 C-N-CA 121.616 1.544 . . . . 0.0 108.444 171.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.7 t -75.81 134.8 71.64 Favored Pre-proline 0 N--CA 1.411 -2.413 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.144 -172.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -73.68 -20.97 19.6 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 122.619 2.213 . . . . 0.0 111.487 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -159.31 144.14 11.45 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 -177.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -57.52 -19.74 38.04 Favored 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 122.512 2.141 . . . . 0.0 114.091 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.43 -11.69 59.91 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 121.122 -0.986 . . . . 0.0 112.162 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.83 -8.1 56.7 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.076 0.941 . . . . 0.0 109.269 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 30.7 mt -90.12 2.1 55.67 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.864 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -133.8 23.94 3.96 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 122.448 1.118 . . . . 0.0 108.144 178.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.657 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 25.4 t70 -98.18 176.43 5.74 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 113.778 -1.556 . . . . 0.0 110.269 -175.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.657 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.55 -23.2 61.72 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 123.387 0.675 . . . . 0.0 111.132 178.5 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.52 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 41.9 ttm180 -72.94 -26.38 61.36 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 176.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.786 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.5 tpp -61.07 -38.62 86.87 Favored 'General case' 0 C--O 1.193 -1.87 0 CA-C-N 114.518 -1.219 . . . . 0.0 112.636 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.523 ' O ' ' HB3' ' A' ' 45' ' ' ALA . 7.2 pt-20 -59.24 -32.07 69.65 Favored 'General case' 0 C--O 1.204 -1.295 0 C-N-CA 118.886 -1.126 . . . . 0.0 110.757 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -75.46 -46.29 33.44 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 123.839 0.855 . . . . 0.0 110.29 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 68.4 mt -63.82 -47.07 82.3 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.793 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.786 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.5 p -72.16 -28.55 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.938 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.58 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -57.06 -47.35 81.19 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 176.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.51 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.6 t80 -61.28 -47.99 83.44 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.833 174.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.452 ' CB ' HG11 ' A' ' 19' ' ' VAL . . . -59.52 -44.2 93.22 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.757 -176.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -62.38 -42.47 99.44 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.433 0.693 . . . . 0.0 111.314 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.51 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 55.8 pttt -69.27 -39.72 78.22 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.297 0.57 . . . . 0.0 110.635 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 49.4 t -69.5 -47.8 70.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.002 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.473 ' OE2' HD23 ' A' ' 68' ' ' LEU . 12.6 mm-40 -60.73 -37.54 82.09 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.559 178.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.87 -39.19 97.19 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.54 -0.755 . . . . 0.0 112.082 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.24 -52.84 63.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.807 0.337 . . . . 0.0 110.515 177.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -68.87 -30.15 68.6 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.44 -47.32 86.63 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 175.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.62 -19.15 55.98 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.298 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.0 t -79.22 -27.83 42.49 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.208 0.528 . . . . 0.0 110.176 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.76 165.29 13.01 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-O 121.627 0.727 . . . . 0.0 112.692 -175.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -116.95 18.41 14.71 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.436 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.8 p -168.45 158.54 9.72 Favored 'General case' 0 CA--C 1.49 -1.34 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 173.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.85 -30.7 65.72 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.969 177.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -58.78 -47.49 84.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.111 -0.949 . . . . 0.0 108.911 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -65.86 -46.41 78.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.392 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -45.07 92.98 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -176.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.455 ' HA ' ' CD2' ' A' ' 68' ' ' LEU . 7.6 t80 -63.55 -39.7 95.09 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.601 178.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -62.7 -55.86 22.94 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.4 pp -65.35 -33.14 75.27 Favored 'General case' 0 C--O 1.255 1.39 0 CA-C-O 121.598 0.713 . . . . 0.0 111.482 -175.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.494 HD21 HD21 ' A' ' 18' ' ' LEU . 1.4 pp -73.42 -32.41 64.4 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.909 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.4 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -68.44 -33.97 75.14 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.674 178.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -66.1 -43.16 88.05 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.403 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.494 ' NZ ' ' HB2' ' A' ' 68' ' ' LEU . 1.4 pptp? -65.17 -42.67 93.44 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 119.811 -0.756 . . . . 0.0 111.925 179.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.576 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.1 tt -65.94 -40.42 87.37 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.693 0 CA-C-O 121.006 0.432 . . . . 0.0 110.163 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.514 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 62.6 t80 -57.33 -52.86 63.64 Favored 'General case' 0 C--O 1.272 2.261 0 C-N-CA 124.963 1.305 . . . . 0.0 110.495 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.1 ptpt -64.38 -33.07 75.0 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.225 -178.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.72 -38.31 81.98 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.992 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.585 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 53.0 mt-30 -69.62 -43.86 71.84 Favored 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.626 -175.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.554 ' HB3' ' HZ3' ' A' ' 77' ' ' LYS . 0.2 OUTLIER -70.44 -28.24 64.87 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 118.648 -1.221 . . . . 0.0 112.782 175.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -61.74 -49.41 76.51 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 175.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.4 pp -64.84 -40.45 95.2 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.76 -176.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.423 ' N ' HD11 ' A' ' 79' ' ' LEU . 45.9 mt-10 -62.68 -50.42 71.22 Favored 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 123.665 0.603 . . . . 0.0 112.211 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.5 pt-20 -72.57 -32.09 65.75 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 119.708 -0.797 . . . . 0.0 112.787 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.54 -35.23 80.23 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -77.61 -39.18 46.26 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.027 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.417 ' O ' ' HB2' ' A' ' 85' ' ' SER . 7.8 tmm_? -70.79 -58.68 3.38 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 118.605 -0.712 . . . . 0.0 111.523 -177.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.417 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 30.3 t 167.8 104.25 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.418 0.687 . . . . 0.0 111.429 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -132.93 -31.8 1.27 Allowed 'General case' 0 C--N 1.316 -0.868 0 O-C-N 121.505 -0.747 . . . . 0.0 109.846 169.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 69.3 mt . . . . . 0 C--O 1.249 1.049 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -178.029 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.519 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 26.3 t -154.93 140.23 17.65 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 106.725 -1.584 . . . . 0.0 106.725 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' MET . . . . . 0.436 ' O ' ' HG3' ' B' ' 112' ' ' GLN . 22.9 ptp -74.41 -21.22 59.74 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.541 -178.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 32.8 t -90.37 -84.93 0.23 Allowed 'General case' 0 N--CA 1.421 -1.889 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 63.2 t-80 65.3 -42.09 0.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 126.055 1.742 . . . . 0.0 114.418 175.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . 0.542 ' HA ' ' OE1' ' B' ' 109' ' ' GLN . 80.1 t80 84.19 127.5 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 126.699 2.0 . . . . 0.0 109.118 -169.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 90.65 -21.01 35.03 Favored Glycine 0 C--O 1.214 -1.096 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -89.35 1.2 56.12 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 124.317 1.047 . . . . 0.0 109.754 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . 0.542 ' OE1' ' HA ' ' B' ' 106' ' ' TYR . 1.9 mp0 -60.67 -33.65 73.14 Favored 'General case' 0 CA--C 1.498 -1.024 0 CA-C-N 115.047 -0.978 . . . . 0.0 109.985 178.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' THR . . . . . 0.568 ' O ' ' HB2' ' B' ' 114' ' ' LEU . 19.6 p -58.17 -52.74 64.28 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.36 -179.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 64.1 tp -61.56 -50.57 72.1 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.806 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' B' ' 103' ' ' MET . 15.6 mm100 -64.67 -52.58 56.5 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -175.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -68.71 -36.8 78.91 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.392 -173.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.568 ' HB2' ' O ' ' B' ' 110' ' ' THR . 0.2 OUTLIER -73.66 -31.92 63.73 Favored 'General case' 0 C--O 1.212 -0.9 0 C-N-CA 120.48 -0.488 . . . . 0.0 111.315 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.404 ' O ' ' HB3' ' B' ' 118' ' ' ASP . 51.6 tp -67.4 -41.85 84.25 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 175.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.8 m -65.71 -39.46 91.22 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.27 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.422 ' HA ' ' HB2' ' B' ' 120' ' ' LEU . 22.5 m -77.37 -20.65 54.45 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.386 0.613 . . . . 0.0 111.375 178.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.404 ' HB3' ' O ' ' B' ' 115' ' ' LEU . 9.8 t70 -66.56 -48.96 67.97 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 22.8 m -72.72 -9.46 58.66 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.271 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . 0.491 HD22 ' O ' ' B' ' 120' ' ' LEU . 4.6 tt -72.02 -8.92 57.32 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 20.9 t -60.24 -45.28 93.8 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -90.42 73.45 6.96 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 173.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 49.7 m -153.82 167.38 29.87 Favored 'General case' 0 C--O 1.256 1.421 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -90.1 -80.67 0.31 Allowed 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -173.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 121.3 -140.49 14.02 Favored Glycine 0 N--CA 1.44 -1.097 0 C-N-CA 120.555 -0.831 . . . . 0.0 111.27 -177.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -123.2 -108.0 1.87 Allowed Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.999 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -152.54 -29.83 0.04 OUTLIER Glycine 0 C--N 1.31 -0.887 0 C-N-CA 121.397 -0.43 . . . . 0.0 112.777 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.8 m -84.28 176.71 8.55 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.872 0.367 . . . . 0.0 111.225 -176.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -127.04 -108.68 1.55 Allowed Glycine 0 N--CA 1.439 -1.155 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -149.0 175.18 28.36 Favored Glycine 0 C--O 1.252 1.243 0 C-N-CA 121.001 -0.619 . . . . 0.0 111.958 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -157.48 154.42 25.52 Favored Glycine 0 N--CA 1.439 -1.138 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.2 t -147.78 -165.23 2.2 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 109.047 -0.724 . . . . 0.0 109.047 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 136.91 126.86 2.57 Favored Glycine 0 C--O 1.245 0.804 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -177.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . 0.414 ' N ' ' HB2' ' A' ' 13' ' ' ASP . . . 145.46 -131.97 4.42 Favored Glycine 0 C--N 1.31 -0.874 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -179.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . 0.403 ' HA2' ' OE1' ' B' ' 138' ' ' GLU . . . 132.89 109.51 1.16 Allowed Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.473 -0.87 . . . . 0.0 111.712 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.2 m -147.88 -61.12 0.26 Allowed 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.16 0.505 . . . . 0.0 111.075 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.66 ' O ' ' HB2' ' B' ' 141' ' ' MET . 86.2 mt -101.0 -45.12 5.51 Favored 'General case' 0 C--O 1.216 -0.71 0 O-C-N 122.149 -0.344 . . . . 0.0 111.156 -173.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.457 ' HA ' ' HE3' ' B' ' 141' ' ' MET . 0.0 OUTLIER -50.98 -42.89 60.44 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 124.866 1.266 . . . . 0.0 112.865 -177.213 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 39.0 m -39.38 -58.12 1.28 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.48 1.512 . . . . 0.0 114.154 -174.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -121.25 32.02 6.1 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 123.038 1.399 . . . . 0.0 110.17 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.66 ' HB2' ' O ' ' B' ' 137' ' ' LEU . 26.3 ttp -93.33 -9.37 39.08 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.038 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -14.82 -71.98 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 127.22 2.208 . . . . 0.0 116.711 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 20.2 m -70.5 -38.8 74.36 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 122.01 -0.432 . . . . 0.0 111.623 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 66.8 mt -66.88 -45.95 86.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.406 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 14.7 tt -66.04 -37.21 79.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.349 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -61.29 -52.84 63.02 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.6 t -68.63 -54.06 18.74 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -176.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -80.96 -37.4 29.46 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -173.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 52.7 tp -84.84 -24.82 28.44 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.205 0.457 . . . . 0.0 109.932 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 28.3 ttt 82.9 89.76 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 173.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -107.93 88.93 2.85 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.575 0 O-C-N 123.848 0.717 . . . . 0.0 111.566 -173.74 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.517 0 N-CA-C 110.471 -1.051 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 15.3 m -81.65 114.11 22.06 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.18 108.44 18.91 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 122.542 1.163 . . . . 0.0 111.432 -171.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.461 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 39.1 mttp -95.41 118.62 32.47 Favored 'General case' 0 C--N 1.273 -2.718 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.061 -172.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -67.22 -17.42 68.13 Favored Glycine 0 C--N 1.317 -0.495 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.497 -176.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.461 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 63.1 p-90 -68.19 -10.25 52.96 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.438 ' HB2' ' HH ' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -62.48 -17.61 59.96 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.086 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -81.67 -9.46 59.65 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 121.162 0.506 . . . . 0.0 109.989 177.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.44 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 53.5 m-70 -101.63 9.66 40.9 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.91 -178.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.6 p -140.05 110.86 4.19 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.732 0 CA-C-O 122.24 1.019 . . . . 0.0 109.429 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 m -88.38 161.29 17.17 Favored 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.095 -0.957 . . . . 0.0 108.705 -176.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -36.9 64.83 Favored 'General case' 0 C--O 1.195 -1.81 0 C-N-CA 122.891 0.477 . . . . 0.0 110.17 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -52.09 -46.43 65.22 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 123.919 0.888 . . . . 0.0 113.134 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.49 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.4 tm? -70.19 -50.64 38.08 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -174.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.554 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.1 ptm180 -64.17 -44.65 91.42 Favored 'General case' 0 N--CA 1.421 -1.891 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.12 -177.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.0 t -63.66 -30.48 71.58 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 122.966 0.507 . . . . 0.0 110.546 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -65.31 -47.22 77.35 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.49 HD11 ' O ' ' A' ' 14' ' ' LEU . 5.4 mp -65.61 -40.92 93.15 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.476 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.554 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.2 t -58.84 -46.4 91.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 124.636 1.174 . . . . 0.0 110.166 176.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -57.32 -51.91 67.49 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.326 177.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.2 mttp -62.26 -40.33 95.83 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.692 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.527 ' O ' HG23 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -51.84 -52.61 48.1 Favored 'General case' 0 CA--C 1.508 -0.667 0 C-N-CA 124.401 1.08 . . . . 0.0 108.922 176.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.425 HG11 ' HE3' ' A' ' 40' ' ' MET . 39.4 t -54.1 -51.22 48.8 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.207 0 O-C-N 124.308 1.005 . . . . 0.0 110.752 176.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -56.92 -34.57 68.08 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -176.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.37 -46.76 14.19 Favored 'General case' 0 C--O 1.195 -1.795 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.74 177.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.6 HG22 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.84 -26.49 17.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 CA-C-O 122.063 0.935 . . . . 0.0 110.95 -174.073 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.6 ' CD2' HG22 ' A' ' 26' ' ' ILE . 69.4 m-85 -124.94 91.66 49.0 Favored Pre-proline 0 C--N 1.283 -2.305 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.129 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -65.68 102.02 0.49 Allowed 'Trans proline' 0 C--O 1.247 0.943 0 C-N-CA 122.134 1.89 . . . . 0.0 111.001 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.447 ' OG1' ' HB2' ' A' ' 34' ' ' ALA . 12.7 t -77.23 136.99 64.83 Favored Pre-proline 0 N--CA 1.423 -1.792 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.227 -176.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -76.5 -27.49 7.63 Favored 'Trans proline' 0 C--O 1.244 0.783 0 C-N-CA 122.974 2.449 . . . . 0.0 112.154 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -147.52 149.19 33.42 Favored Pre-proline 0 CA--C 1.485 -1.528 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.29 -9.91 26.85 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 121.626 1.551 . . . . 0.0 111.702 177.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.24 -10.44 57.69 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.15 0.5 . . . . 0.0 111.522 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.447 ' HB2' ' OG1' ' A' ' 29' ' ' THR . . . -81.11 -6.56 58.97 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.936 0.874 . . . . 0.0 109.025 176.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.504 ' O ' ' HG2' ' A' ' 40' ' ' MET . 21.8 mt -90.85 5.55 48.03 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.366 -178.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -133.48 17.71 3.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.107 0.956 . . . . 0.0 108.926 177.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.619 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 15.3 t70 -88.54 176.69 7.04 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.974 -176.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.619 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.8 OUTLIER -71.29 -26.72 62.99 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 173.915 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.569 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 32.2 ttm180 -59.4 -36.05 75.11 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.933 -1.03 . . . . 0.0 109.391 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.504 ' HG2' ' O ' ' A' ' 35' ' ' LEU . 8.6 tpp -58.75 -37.89 77.22 Favored 'General case' 0 C--O 1.212 -0.905 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.869 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -66.76 -27.83 67.92 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 117.947 -1.501 . . . . 0.0 110.072 -178.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -75.03 -42.06 57.97 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.522 0.729 . . . . 0.0 110.208 176.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.58 HD23 ' CG ' ' A' ' 27' ' ' PHE . 28.3 mt -61.92 -53.57 53.95 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.878 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.408 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.0 p -70.22 -27.79 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.597 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.267 -178.154 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 41' ' ' GLU . . . -60.19 -47.67 84.96 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.938 0.399 . . . . 0.0 110.199 175.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.511 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -60.29 -44.7 95.16 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.889 175.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.3 -41.93 97.82 Favored 'General case' 0 C--O 1.199 -1.58 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.485 -177.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.5 mttm -64.65 -44.22 91.14 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 176.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.511 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 58.2 pttt -63.8 -40.55 96.92 Favored 'General case' 0 C--O 1.256 1.424 0 CA-C-O 121.544 0.688 . . . . 0.0 110.373 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.449 HG23 ' CZ ' ' A' ' 46' ' ' TYR . 48.7 t -70.74 -45.32 74.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 114.933 -1.031 . . . . 0.0 110.694 178.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.415 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.9 tm-20 -56.98 -46.2 82.41 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.75 -37.05 92.95 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.624 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -61.04 -52.98 62.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.012 0.434 . . . . 0.0 110.592 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.455 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -69.85 -27.75 65.1 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 179.04 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.438 ' HH ' ' HB2' ' A' ' 7' ' ' HIS . 57.9 t80 -62.83 -49.5 74.67 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 175.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -74.5 -19.51 60.34 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.7 t -79.65 -20.08 47.58 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 120.717 0.294 . . . . 0.0 110.78 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.52 161.67 13.55 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -174.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -107.86 5.6 26.6 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.47 -1.241 . . . . 0.0 110.53 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 75.5 p -164.02 159.51 20.74 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.44 ' NE ' ' HB3' ' A' ' 9' ' ' HIS . 0.2 OUTLIER -72.51 -24.07 61.1 Favored 'General case' 0 C--O 1.197 -1.677 0 C-N-CA 118.91 -1.116 . . . . 0.0 109.818 177.746 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -66.02 -44.46 84.63 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -66.3 -46.34 77.29 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.282 175.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -45.36 89.01 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 123.157 0.286 . . . . 0.0 110.54 -177.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.467 ' HH ' ' HB ' ' B' ' 145' ' ' ILE . 0.9 OUTLIER -60.07 -44.09 95.0 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 123.762 0.664 . . . . 0.0 110.566 177.027 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.4 t-80 -64.75 -50.98 64.74 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.411 HD13 ' CB ' ' A' ' 54' ' ' MET . 4.0 pp -67.3 -32.2 73.03 Favored 'General case' 0 C--O 1.252 1.198 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.218 -174.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.524 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 0.9 OUTLIER -75.95 -31.48 59.08 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 178.268 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.471 ' HB2' ' HA ' ' B' ' 149' ' ' LEU . . . -64.51 -35.28 80.45 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.798 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -72.17 -40.55 67.89 Favored 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 120.304 -0.558 . . . . 0.0 109.985 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.75 -38.87 87.5 Favored 'General case' 0 C--O 1.212 -0.894 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.667 -179.103 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.597 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -68.69 -42.94 83.39 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.291 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -57.22 -51.75 68.07 Favored 'General case' 0 C--O 1.275 2.432 0 C-N-CA 124.64 1.176 . . . . 0.0 110.793 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.9 -36.9 85.87 Favored 'General case' 0 C--O 1.21 -0.988 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.674 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.462 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.3 mp -61.36 -39.82 84.06 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 O-C-N 123.451 0.469 . . . . 0.0 110.182 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.604 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 50.2 mt-30 -64.18 -49.9 70.23 Favored 'General case' 0 CA--C 1.496 -1.1 0 O-C-N 123.636 0.585 . . . . 0.0 110.286 -177.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.459 ' HZ2' ' HB3' ' A' ' 77' ' ' LYS . 0.8 OUTLIER -73.28 -28.22 61.99 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 118.786 -1.166 . . . . 0.0 113.922 179.377 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -64.58 -47.79 77.38 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.0 pp -64.93 -38.99 92.8 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.58 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 52.4 mt-10 -58.49 -54.45 46.94 Favored 'General case' 0 CA--C 1.49 -1.332 0 O-C-N 123.992 0.807 . . . . 0.0 110.302 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 10.6 pt-20 -68.39 -39.05 81.86 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 120.312 -0.555 . . . . 0.0 112.127 -175.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.437 ' HA ' ' CG ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -66.13 -34.17 77.45 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.687 -178.828 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 -77.73 -44.28 28.31 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.279 0.562 . . . . 0.0 110.095 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -81.68 -59.3 2.65 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -171.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.413 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 71.0 m -154.16 91.36 1.42 Allowed 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -169.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.437 ' CG ' ' HA ' ' A' ' 82' ' ' LYS . 12.1 ptm180 177.3 -34.78 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.427 1.891 . . . . 0.0 110.093 171.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 C--O 1.249 1.038 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.24 176.195 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.358 0 N-CA-C 110.634 -0.987 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 38.9 m -81.02 91.41 6.07 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 120.861 0.363 . . . . 0.0 111.641 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 95.5 mmm -83.39 -29.13 28.41 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 172.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 45.3 t -122.3 145.51 48.17 Favored 'General case' 0 N--CA 1.416 -2.167 0 N-CA-C 104.252 -2.499 . . . . 0.0 104.252 170.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -107.68 -70.93 0.78 Allowed 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.099 -177.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 61.8 t80 58.85 90.76 0.05 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 C-N-CA 125.083 1.353 . . . . 0.0 111.757 -178.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 131.98 -30.43 3.21 Favored Glycine 0 N--CA 1.426 -2.015 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -131.77 58.24 1.74 Allowed 'General case' 0 N--CA 1.435 -1.209 0 CA-C-O 122.083 0.944 . . . . 0.0 112.153 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -64.64 -31.57 72.85 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.847 176.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' THR . . . . . 0.472 ' O ' ' HB2' ' B' ' 114' ' ' LEU . 3.4 t -58.88 -33.78 70.89 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.558 176.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 52.9 tp -68.25 -50.89 50.84 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -68.58 -41.97 78.92 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -62.06 -54.76 36.88 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 122.884 0.474 . . . . 0.0 110.211 -178.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' B' ' 110' ' ' THR . 1.2 mm? -66.38 -31.64 72.53 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.846 -0.616 . . . . 0.0 112.336 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 33.5 tp -65.38 -45.87 82.35 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 122.208 -0.307 . . . . 0.0 110.379 175.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 28.7 m -66.65 -39.74 88.36 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.149 0.5 . . . . 0.0 110.332 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 30.3 m -73.19 -22.5 60.45 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.426 0.631 . . . . 0.0 111.944 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -76.83 -34.83 57.87 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 122.106 0.955 . . . . 0.0 108.614 174.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 37.4 t -77.05 -10.31 59.29 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.231 178.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 13.6 tp -58.77 -12.56 4.46 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.132 1.773 . . . . 0.0 114.158 -174.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 14.3 p -53.92 -21.55 8.14 Favored 'General case' 0 CA--C 1.556 1.196 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 -170.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 14.4 p80 -78.55 62.39 3.13 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 -175.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 58.7 m 48.31 104.96 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -138.58 -176.69 4.56 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.105 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 161.29 174.04 30.67 Favored Glycine 0 N--CA 1.424 -2.102 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 106.15 104.43 2.94 Favored Glycine 0 C--N 1.303 -1.28 0 C-N-CA 120.223 -0.989 . . . . 0.0 112.585 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -178.97 -125.82 0.96 Allowed Glycine 0 N--CA 1.426 -1.992 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 48.7 m -153.18 119.22 5.43 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -72.71 171.29 50.26 Favored Glycine 0 C--O 1.242 0.621 0 C-N-CA 121.459 -0.4 . . . . 0.0 112.823 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -177.7 162.6 30.48 Favored Glycine 0 N--CA 1.437 -1.244 0 N-CA-C 111.556 -0.618 . . . . 0.0 111.556 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 146.55 -174.33 26.46 Favored Glycine 0 C--N 1.305 -1.156 0 N-CA-C 110.099 -1.2 . . . . 0.0 110.099 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 16.1 m 66.84 100.39 0.05 OUTLIER 'General case' 0 C--O 1.248 0.997 0 C-N-CA 124.611 1.164 . . . . 0.0 112.118 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -107.99 -102.84 2.81 Favored Glycine 0 N--CA 1.44 -1.065 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.957 -178.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 154.81 4.96 0.1 OUTLIER Glycine 0 C--N 1.308 -0.992 0 C-N-CA 120.713 -0.756 . . . . 0.0 114.153 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 97.63 75.84 1.25 Allowed Glycine 0 CA--C 1.524 0.653 0 C-N-CA 119.994 -1.098 . . . . 0.0 114.546 176.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 35.5 t -97.77 -135.4 0.26 Allowed 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 173.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.519 ' O ' ' HB2' ' B' ' 141' ' ' MET . 95.2 mt -53.64 -27.64 28.3 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 118.319 0.509 . . . . 0.0 111.448 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.44 ' HA ' ' CB ' ' B' ' 141' ' ' MET . 0.0 OUTLIER -68.09 -12.94 61.77 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -178.097 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 54.0 t -65.04 -31.27 72.42 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.085 0.554 . . . . 0.0 111.283 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -129.26 26.02 5.45 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 122.13 0.967 . . . . 0.0 109.901 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.519 ' HB2' ' O ' ' B' ' 137' ' ' LEU . 45.3 ttp -100.58 -9.93 21.49 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.045 -0.979 . . . . 0.0 112.47 -172.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -35.94 -65.96 0.23 Allowed 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.0 p -66.12 -33.92 76.88 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 121.243 0.544 . . . . 0.0 112.103 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 51.2 mm -67.0 -49.59 72.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.975 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.467 ' HB ' ' HH ' ' A' ' 65' ' ' TYR . 21.2 tt -69.7 -31.19 47.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.163 -177.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -57.81 -65.31 0.66 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 20.0 p -67.2 -45.6 76.38 Favored 'General case' 0 C--O 1.247 0.96 0 CA-C-N 114.441 -1.254 . . . . 0.0 113.517 -174.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -80.44 -34.41 36.09 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 69' ' ' ALA . 9.1 tt -97.91 -32.05 11.88 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -170.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . 0.256 0.0 OUTLIER -152.69 157.75 41.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 115.545 -2.462 . . . . 0.0 116.784 -176.538 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -167.1 109.1 0.66 Allowed 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 113.924 -1.489 . . . . 0.0 108.886 178.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.308 -1.222 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 178.283 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.482 -2.012 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 33.8 m -101.62 141.19 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.336 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.143 177.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.433 ' HD2' ' H ' ' A' ' 3' ' ' ARG . 0.1 OUTLIER -96.13 34.92 1.5 Allowed 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 122.374 1.083 . . . . 0.0 109.665 -179.151 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.41 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 76.9 mttt -119.89 118.47 30.85 Favored 'General case' 0 N--CA 1.421 -1.89 0 CA-C-N 114.303 -1.317 . . . . 0.0 109.523 -173.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.01 -21.39 31.03 Favored Glycine 0 C--N 1.321 -0.252 0 CA-C-N 115.243 -0.89 . . . . 0.0 114.947 -176.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.432 ' CG ' ' HA ' ' A' ' 60' ' ' SER . 55.7 p-90 -64.13 -14.69 56.69 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 117.365 0.583 . . . . 0.0 112.368 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -61.29 -12.88 15.21 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 176.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -81.76 -16.85 49.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.66 0.743 . . . . 0.0 109.833 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -105.32 18.69 21.86 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.825 -171.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.67 130.32 9.67 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.831 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.2 m -105.28 162.88 13.04 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 -177.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.15 -36.26 72.72 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 120.792 0.329 . . . . 0.0 110.406 177.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -58.41 -41.33 84.72 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.828 -0.623 . . . . 0.0 112.123 178.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.529 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.2 tm? -68.3 -52.06 37.89 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 -175.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.571 ' O ' HG21 ' A' ' 19' ' ' VAL . 6.4 ptm180 -63.97 -43.84 94.56 Favored 'General case' 0 N--CA 1.415 -2.2 0 CA-C-N 114.301 -1.318 . . . . 0.0 112.849 -176.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 t -66.71 -28.3 68.32 Favored 'General case' 0 N--CA 1.44 -0.962 0 N-CA-C 110.237 -0.282 . . . . 0.0 110.237 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.7 t60 -68.02 -41.98 81.35 Favored 'General case' 0 C--O 1.241 0.644 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.529 HD11 ' O ' ' A' ' 14' ' ' LEU . 5.0 mp -67.02 -40.67 87.29 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.173 -0.922 . . . . 0.0 109.704 177.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.571 HG21 ' O ' ' A' ' 15' ' ' ARG . 76.6 t -56.85 -47.9 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.049 0.94 . . . . 0.0 109.793 174.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.474 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 23.1 t-80 -54.85 -52.23 63.41 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.367 177.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.4 mttp -61.77 -39.76 92.8 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.428 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.49 ' O ' HG22 ' A' ' 26' ' ' ILE . 8.8 mt -52.37 -52.55 52.89 Favored 'General case' 0 CA--C 1.506 -0.748 0 C-N-CA 123.463 0.705 . . . . 0.0 111.0 175.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.436 HG12 ' HE1' ' A' ' 40' ' ' MET . 53.2 t -54.92 -48.7 74.51 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.373 0 O-C-N 124.0 0.812 . . . . 0.0 109.869 176.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.474 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 40.2 mt-30 -57.55 -34.65 69.38 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -175.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.15 -45.54 15.0 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 176.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.512 HG21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.6 -23.42 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 121.988 0.899 . . . . 0.0 110.439 -174.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.512 ' CD2' HG21 ' A' ' 26' ' ' ILE . 66.1 m-85 -133.2 84.62 47.22 Favored Pre-proline 0 C--N 1.284 -2.242 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.18 106.46 0.3 Allowed 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.636 2.224 . . . . 0.0 111.194 -177.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 t -83.73 137.16 41.34 Favored Pre-proline 0 N--CA 1.425 -1.709 0 CA-C-O 121.124 0.488 . . . . 0.0 111.625 -172.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.461 ' HD3' ' OG ' ' B' ' 121' ' ' SER . 73.7 Cg_endo -80.74 -19.93 8.21 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.787 2.325 . . . . 0.0 112.315 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -158.53 159.06 29.93 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.705 -176.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.439 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 58.6 Cg_endo -77.17 -1.46 11.63 Favored 'Trans proline' 0 N--CA 1.442 -1.504 0 C-N-CA 121.446 1.431 . . . . 0.0 113.876 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -95.34 -17.12 21.87 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.692 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.9 -16.05 63.66 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 122.189 0.995 . . . . 0.0 108.845 172.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.517 ' O ' ' HG2' ' A' ' 40' ' ' MET . 33.3 mt -87.36 1.23 53.92 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.276 -1.329 . . . . 0.0 111.374 -179.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -133.04 24.16 4.22 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-O 122.407 1.099 . . . . 0.0 108.888 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.571 ' O ' ' HB3' ' A' ' 40' ' ' MET . 25.6 t70 -82.36 170.92 14.78 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 114.053 -1.43 . . . . 0.0 108.151 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.537 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.81 -25.5 62.89 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-O 121.903 0.859 . . . . 0.0 109.743 179.115 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.528 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 21.4 ttp180 -77.4 -15.78 59.18 Favored 'General case' 0 C--O 1.251 1.139 0 C-N-CA 124.442 1.097 . . . . 0.0 110.204 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.604 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.5 tpp -59.55 -32.94 70.8 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.068 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 45' ' ' ALA . 0.5 OUTLIER -62.32 -33.55 74.91 Favored 'General case' 0 C--O 1.184 -2.349 0 C-N-CA 119.003 -1.079 . . . . 0.0 110.595 -179.771 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -70.99 -46.14 62.79 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 121.266 0.555 . . . . 0.0 109.556 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 18.7 mt -59.36 -51.09 71.4 Favored 'General case' 0 C--O 1.245 0.868 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.11 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.604 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -72.86 -28.59 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.058 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.728 -177.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -61.37 -46.42 90.25 Favored 'General case' 0 C--O 1.246 0.896 0 N-CA-C 109.794 -0.446 . . . . 0.0 109.794 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.502 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.5 t80 -59.58 -47.04 87.12 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.773 173.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.78 -41.63 95.95 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.771 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -63.02 -46.27 88.37 Favored 'General case' 0 C--O 1.216 -0.676 0 O-C-N 123.46 0.475 . . . . 0.0 111.613 176.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.502 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 17.4 pttp -64.37 -38.81 92.36 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-O 121.631 0.729 . . . . 0.0 110.885 -176.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.416 HG22 ' CZ ' ' A' ' 46' ' ' TYR . 51.7 t -72.1 -45.26 63.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.551 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -57.07 -45.33 83.36 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 177.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.02 -40.06 95.05 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.273 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -61.12 -52.93 62.82 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.173 0.511 . . . . 0.0 111.195 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.435 ' HE3' ' HB3' ' A' ' 54' ' ' MET . 0.2 OUTLIER -67.4 -30.35 70.1 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 178.475 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -63.06 -53.76 48.73 Favored 'General case' 0 C--O 1.196 -1.759 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -73.04 -20.97 60.88 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 122.048 -0.407 . . . . 0.0 111.463 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.8 t -77.67 -42.49 34.47 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.2 162.39 28.46 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -173.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -102.89 4.53 37.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.147 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.432 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 66.7 p -160.17 160.04 32.39 Favored 'General case' 0 CA--C 1.488 -1.439 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.07 -24.26 61.48 Favored 'General case' 0 C--O 1.206 -1.215 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.152 176.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -68.07 -47.81 67.27 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -61.45 -43.92 98.02 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.462 176.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -48.38 77.03 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 123.36 0.412 . . . . 0.0 110.389 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.497 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 0.3 OUTLIER -60.58 -45.93 92.11 Favored 'General case' 0 N--CA 1.433 -1.311 0 O-C-N 123.882 0.739 . . . . 0.0 110.32 177.785 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.638 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 20.4 m80 -67.41 -42.74 82.78 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -178.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 pp -71.27 -31.63 67.72 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.56 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.496 HD21 HD23 ' A' ' 18' ' ' LEU . 1.7 pp -73.83 -32.85 63.88 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 178.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.495 ' O ' HG22 ' A' ' 72' ' ' ILE . . . -64.83 -37.31 87.18 Favored 'General case' 0 C--O 1.197 -1.703 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.225 175.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.638 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 69.9 mm-40 -64.16 -43.89 93.76 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-O 121.824 0.821 . . . . 0.0 110.25 177.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.493 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -69.88 -41.05 75.28 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.4 -177.469 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.495 HG22 ' O ' ' A' ' 69' ' ' ALA . 5.8 tt -68.5 -34.66 66.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.43 0.634 . . . . 0.0 109.467 -178.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.564 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 39.1 t80 -57.49 -54.4 47.26 Favored 'General case' 0 C--O 1.261 1.682 0 C-N-CA 125.8 1.64 . . . . 0.0 109.318 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.2 ptpt -64.75 -33.84 76.93 Favored 'General case' 0 C--O 1.207 -1.157 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.376 -178.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.438 HD11 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -63.61 -38.8 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-O 120.652 0.263 . . . . 0.0 110.858 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.531 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 37.6 mt-30 -69.07 -44.36 72.73 Favored 'General case' 0 CA--C 1.501 -0.942 0 C-N-CA 120.535 -0.466 . . . . 0.0 111.294 -177.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.565 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -72.15 -28.19 63.08 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 118.42 -1.312 . . . . 0.0 112.005 177.453 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.86 -49.04 77.85 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 176.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -64.15 -42.3 96.81 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.879 -178.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.55 -45.13 95.46 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -75.39 -32.72 60.87 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.837 -0.745 . . . . 0.0 111.936 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.85 -38.26 88.4 Favored 'General case' 0 C--N 1.348 0.504 0 CA-C-O 121.01 0.433 . . . . 0.0 110.133 -178.852 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.414 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 48.3 ttp180 -77.84 -37.76 47.72 Favored 'General case' 0 N--CA 1.427 -1.617 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.608 178.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -77.02 -59.73 2.66 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 119.631 -0.828 . . . . 0.0 113.095 -176.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 67.7 m -169.29 110.56 0.47 Allowed 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -174.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.447 ' CD ' ' HA ' ' A' ' 82' ' ' LYS . 16.8 ptm180 -169.92 -34.44 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.573 0.749 . . . . 0.0 110.306 172.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 84.7 mt . . . . . 0 C--O 1.247 0.957 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.736 -178.406 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.677 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 70.0 m 65.22 33.75 9.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 122.044 0.926 . . . . 0.0 111.994 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.81 -10.07 57.54 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 173.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 32.7 t -143.7 105.23 4.3 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 173.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 47.9 m80 -76.03 92.42 3.17 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 121.527 0.68 . . . . 0.0 111.961 -178.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . 0.505 ' HA ' HE22 ' B' ' 109' ' ' GLN . 36.2 t80 -145.26 130.11 18.21 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 173.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 96.03 -40.78 2.54 Favored Glycine 0 N--CA 1.439 -1.103 0 N-CA-C 108.794 -1.722 . . . . 0.0 108.794 -175.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -117.01 70.35 0.77 Allowed 'General case' 0 N--CA 1.434 -1.265 0 CA-C-O 122.351 1.072 . . . . 0.0 111.928 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . 0.505 HE22 ' HA ' ' B' ' 106' ' ' TYR . 1.2 mp0 -71.64 -35.84 70.52 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 173.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 11.1 p -55.56 -35.95 66.29 Favored 'General case' 0 N--CA 1.417 -2.077 0 CA-C-N 112.32 -2.218 . . . . 0.0 113.048 -177.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 57.5 tp -58.57 -64.31 0.97 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -71.16 -35.36 71.62 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.776 -0.369 . . . . 0.0 111.216 -177.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -61.93 -58.38 8.15 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.424 0.63 . . . . 0.0 110.201 -178.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' B' ' 118' ' ' ASP . 26.5 tp -73.56 -19.72 60.82 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.388 -175.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 63.3 tp -70.45 -41.67 72.52 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 172.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.6 m -72.24 -42.58 65.51 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.954 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.8 m -62.27 -34.6 76.88 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.245 0.545 . . . . 0.0 110.489 176.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 13.8 t70 -64.3 -43.87 93.38 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 177.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 38.3 m -64.25 -33.35 75.61 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.854 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 8.0 tt -62.67 -39.72 94.82 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 123.267 0.627 . . . . 0.0 110.327 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' SER . . . . . 0.461 ' OG ' ' HD3' ' A' ' 30' ' ' PRO . 33.3 t -75.47 -45.08 40.64 Favored 'General case' 0 C--O 1.256 1.399 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 177.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 70.6 t60 78.59 -38.32 0.23 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.312 1.445 . . . . 0.0 113.915 173.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 23.6 m -115.21 155.4 27.26 Favored 'General case' 0 C--N 1.311 -1.102 0 O-C-N 121.962 -0.461 . . . . 0.0 110.993 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -108.04 139.02 43.3 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 122.842 0.457 . . . . 0.0 111.517 -177.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . 0.435 ' N ' ' HA ' ' A' ' 30' ' ' PRO . . . -164.19 -168.48 26.33 Favored Glycine 0 N--CA 1.443 -0.866 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -102.37 135.84 12.48 Favored Glycine 0 N--CA 1.445 -0.732 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -96.1 70.84 0.9 Allowed Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.834 -0.698 . . . . 0.0 113.162 -177.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 8.5 p -79.52 115.1 18.95 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 122.667 0.387 . . . . 0.0 110.626 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -171.03 143.38 7.64 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -138.95 -132.43 2.95 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.654 -177.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 94.91 102.73 1.83 Allowed Glycine 0 C--N 1.317 -0.52 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 13.3 m -138.96 141.1 38.42 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -90.03 -106.94 1.25 Allowed Glycine 0 C--N 1.308 -0.975 0 N-CA-C 112.005 -0.438 . . . . 0.0 112.005 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . 0.404 ' N ' ' HG2' ' B' ' 138' ' ' GLU . . . 156.17 82.06 0.04 OUTLIER Glycine 0 N--CA 1.434 -1.461 0 C-N-CA 120.22 -0.99 . . . . 0.0 112.98 178.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -119.55 -42.24 0.54 Allowed Glycine 0 C--N 1.311 -0.854 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 27.7 t -146.67 -56.71 0.27 Allowed 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 74.5 mt -106.39 -36.77 6.72 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-O 121.48 0.657 . . . . 0.0 111.564 -177.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.438 ' HA ' ' SD ' ' B' ' 141' ' ' MET . 0.1 OUTLIER -71.23 -10.78 60.33 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -169.274 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 19.8 t -59.39 -58.27 9.35 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -174.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -139.99 72.07 1.39 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.438 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 23.5 ptt? -104.05 -32.26 9.29 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 -173.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.445 ' HA ' ' CG2' ' B' ' 145' ' ' ILE 0.339 38.6 mt-10 -37.19 -47.16 0.76 Allowed 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -168.012 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.6 m -64.26 -52.42 58.78 Favored 'General case' 0 C--O 1.267 1.991 0 CA-C-O 121.705 0.764 . . . . 0.0 110.169 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 46.3 mm -64.53 -51.54 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.098 -176.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.497 ' HA ' ' OH ' ' A' ' 65' ' ' TYR . 10.7 tt -58.76 -43.74 88.63 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.688 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.747 -177.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -61.59 -45.7 93.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.264 0.078 . . . . 0.0 110.852 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 20.8 p -66.54 -32.24 73.47 Favored 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -80.73 -31.36 36.06 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.283 0.563 . . . . 0.0 110.308 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 12.8 tp -68.21 -54.66 16.22 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.673 -175.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.481 ' HG2' ' NE2' ' A' ' 76' ' ' GLN . 0.0 OUTLIER -164.92 -175.66 3.85 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.093 -171.328 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -131.84 -66.02 0.73 Allowed 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 175.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.407 -2.617 0 N-CA-C 101.048 -3.686 . . . . 0.0 101.048 -179.568 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.5 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.4 m -89.52 124.44 42.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.88 61.94 7.1 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 122.921 1.343 . . . . 0.0 111.2 -176.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.491 ' HD3' ' NE1' ' A' ' 6' ' ' TRP . 14.3 ptpt -148.0 107.69 3.98 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 114.108 -1.405 . . . . 0.0 109.21 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.94 -25.9 32.26 Favored Glycine 0 C--O 1.239 0.439 0 CA-C-N 114.783 -1.099 . . . . 0.0 115.11 -172.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.491 ' NE1' ' HD3' ' A' ' 4' ' ' LYS . 67.3 p-90 -66.72 -4.66 9.48 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -64.47 -21.44 66.66 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.07 0.462 . . . . 0.0 111.081 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -89.33 0.14 57.03 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.776 0.798 . . . . 0.0 110.065 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 -106.4 6.53 30.46 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.388 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.411 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.3 p -136.02 111.08 11.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 CA-C-N 115.312 -0.858 . . . . 0.0 108.955 -178.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 m -81.72 152.85 26.84 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.834 -175.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.96 70.58 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.309 177.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -63.57 -33.88 76.57 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.521 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.0 tm? -70.6 -52.25 22.72 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -176.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.555 ' O ' HG22 ' A' ' 19' ' ' VAL . 7.0 ptm180 -65.03 -42.73 94.09 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.843 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.7 t -63.99 -31.26 72.38 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 178.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.517 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 31.0 t60 -69.66 -40.19 76.59 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.204 0.526 . . . . 0.0 109.714 178.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.521 HD13 ' O ' ' A' ' 14' ' ' LEU . 5.5 mp -65.57 -41.34 93.04 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.997 176.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 15' ' ' ARG . 69.8 t -57.13 -49.04 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 123.822 0.849 . . . . 0.0 109.628 174.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -52.28 -52.4 52.98 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.869 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.517 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 58.0 mttm -63.79 -41.06 98.0 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.805 178.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.55 ' O ' HG22 ' A' ' 26' ' ' ILE . 15.1 mt -50.7 -51.94 44.91 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 123.966 0.791 . . . . 0.0 109.949 176.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.42 HG11 ' HE2' ' A' ' 40' ' ' MET . 72.5 t -56.89 -51.04 73.12 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.697 0 O-C-N 124.206 0.941 . . . . 0.0 111.423 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -54.02 -37.64 64.3 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.445 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -82.17 -46.65 13.5 Favored 'General case' 0 C--O 1.21 -0.997 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 177.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.55 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -75.51 -22.21 16.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.66 0 CA-C-O 122.051 0.929 . . . . 0.0 110.102 -174.345 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.572 ' CG ' HD23 ' A' ' 43' ' ' LEU . 58.4 m-85 -130.58 84.1 60.08 Favored Pre-proline 0 C--N 1.275 -2.652 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.631 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -59.25 107.01 0.33 Allowed 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.865 1.71 . . . . 0.0 109.874 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.2 t -84.42 149.08 54.1 Favored Pre-proline 0 C--N 1.29 -1.993 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.055 -174.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.56 -28.61 14.19 Favored 'Trans proline' 0 C--O 1.243 0.737 0 C-N-CA 122.404 2.069 . . . . 0.0 111.427 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -155.7 161.06 30.27 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.243 -177.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.419 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 57.0 Cg_endo -78.72 -3.5 13.33 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 121.931 1.754 . . . . 0.0 114.623 -177.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 36' ' ' LYS . . . -96.89 -16.97 20.45 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.245 0.545 . . . . 0.0 109.868 177.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.614 ' HA ' ' OD2' ' A' ' 37' ' ' ASP . . . -66.06 -17.02 64.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 122.466 1.127 . . . . 0.0 108.828 173.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.419 ' CD1' ' HA ' ' A' ' 32' ' ' PRO . 55.8 mt -80.81 5.42 16.02 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 113.458 -1.701 . . . . 0.0 111.056 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.524 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 15.6 ptpt -133.82 6.19 3.69 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.179 0.514 . . . . 0.0 110.722 173.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.614 ' OD2' ' HA ' ' A' ' 34' ' ' ALA . 69.6 m-20 -85.25 179.71 7.16 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.826 178.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.447 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.4 OUTLIER -59.18 -24.83 63.41 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.307 0.643 . . . . 0.0 111.836 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.621 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 22.6 tpp180 -65.27 -35.65 81.69 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.836 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.1 tpp -59.59 -35.07 73.59 Favored 'General case' 0 C--O 1.191 -1.986 0 CA-C-N 114.715 -1.129 . . . . 0.0 112.693 -177.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.502 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 13.9 pt-20 -60.92 -32.92 72.39 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.475 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -78.57 -43.89 25.48 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.18 0.514 . . . . 0.0 110.133 178.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 16.5 mt -60.77 -50.95 71.4 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.583 -178.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.836 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.5 p -68.84 -32.95 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.59 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.049 -179.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.502 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -57.13 -46.42 82.68 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-O 120.759 0.314 . . . . 0.0 110.552 177.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.543 ' CZ ' HG22 ' A' ' 50' ' ' VAL . 3.8 t80 -61.67 -46.75 88.4 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.044 174.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.73 -37.84 88.16 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 120.319 -0.553 . . . . 0.0 111.543 -176.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 91.8 mttt -66.74 -43.1 85.09 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 123.232 0.613 . . . . 0.0 111.501 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.9 pttp -67.27 -37.29 83.2 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.543 HG22 ' CZ ' ' A' ' 46' ' ' TYR . 37.3 t -71.26 -48.0 56.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.603 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.3 tm-20 -57.55 -48.25 79.81 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 123.428 0.691 . . . . 0.0 109.584 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.41 -35.17 91.31 Favored Glycine 0 C--N 1.332 0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.308 178.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -63.52 -52.51 60.89 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 122.729 0.412 . . . . 0.0 110.273 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.409 ' HG2' ' O ' ' A' ' 50' ' ' VAL . 0.0 OUTLIER -67.86 -30.61 70.03 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 177.883 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -62.6 -41.48 99.0 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 175.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -78.81 -21.84 47.11 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.862 178.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.5 t -84.48 -29.46 26.01 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-O 121.164 0.507 . . . . 0.0 110.869 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.95 166.67 13.77 Favored 'General case' 0 C--O 1.245 0.84 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -176.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -116.72 6.93 13.35 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.416 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.6 p -157.99 158.34 34.71 Favored 'General case' 0 CA--C 1.475 -1.918 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 173.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.411 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.4 -26.21 61.79 Favored 'General case' 0 C--O 1.2 -1.522 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.926 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -66.18 -45.08 82.13 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -62.14 -46.78 87.49 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.15 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.28 -47.4 76.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.816 -0.175 . . . . 0.0 110.928 -177.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -58.96 -46.09 88.9 Favored 'General case' 0 C--O 1.208 -1.11 0 C-N-CA 123.459 0.704 . . . . 0.0 110.091 176.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -64.28 -49.61 71.15 Favored 'General case' 0 C--O 1.213 -0.84 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 pp -68.09 -32.51 72.87 Favored 'General case' 0 C--O 1.255 1.395 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.609 -176.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.506 HD21 HD21 ' A' ' 18' ' ' LEU . 1.1 pp -74.47 -35.05 63.27 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.485 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -62.8 -37.46 86.79 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.535 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -64.3 -44.51 91.4 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.954 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.411 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -68.4 -42.23 79.33 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.859 -178.575 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.509 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 7.0 tt -63.49 -44.14 98.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.564 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.472 ' CD2' ' HB2' ' B' ' 150' ' ' MET . 35.7 t80 -55.3 -54.19 46.69 Favored 'General case' 0 C--O 1.259 1.582 0 C-N-CA 124.97 1.308 . . . . 0.0 110.035 -179.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.0 ptpt -65.12 -32.02 73.51 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.597 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -67.77 -40.94 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 122.96 0.504 . . . . 0.0 111.189 178.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.509 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 43.2 mt-30 -66.21 -39.56 89.71 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.379 0.609 . . . . 0.0 109.425 -179.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.653 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS 0.267 0.0 OUTLIER -71.86 -27.21 62.72 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 174.134 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.481 ' OE1' HD23 ' B' ' 114' ' ' LEU . 2.2 tm-20 -64.9 -52.21 57.71 Favored 'General case' 0 C--N 1.309 -1.196 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.463 ' HA ' ' CG ' ' A' ' 82' ' ' LYS . 4.7 pp -62.16 -37.03 83.64 Favored 'General case' 0 C--O 1.248 1.015 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.142 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.506 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 12.9 pt-20 -65.93 -44.89 83.76 Favored 'General case' 0 N--CA 1.439 -1.0 0 C-N-CA 119.791 -0.763 . . . . 0.0 110.606 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -70.61 -43.34 69.5 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.54 -177.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.557 ' HA ' ' CG ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -62.19 -46.35 89.31 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -177.255 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 25.5 ttm180 -77.0 -32.59 57.31 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 123.359 0.412 . . . . 0.0 110.594 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -70.32 -56.68 6.12 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -177.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.431 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 23.3 t -166.48 89.96 0.4 Allowed 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.557 ' CG ' ' HA ' ' A' ' 82' ' ' LYS . 13.7 ptm180 -179.47 -30.65 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.012 1.725 . . . . 0.0 109.732 169.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.9 mp . . . . . 0 N--CA 1.47 0.55 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 173.856 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.85 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 32.8 t -70.82 -36.16 72.81 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 123.287 0.635 . . . . 0.0 111.026 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 96.4 mmm -91.4 -8.47 47.82 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.83 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 39.9 m -62.98 126.1 26.21 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . 0.406 ' HB3' ' OE1' ' B' ' 112' ' ' GLN . 42.4 m80 77.75 -33.48 0.18 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.804 1.242 . . . . 0.0 112.447 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -81.5 -17.69 47.73 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.974 0.416 . . . . 0.0 111.027 178.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -88.27 -69.5 1.28 Allowed Glycine 0 N--CA 1.423 -2.178 0 N-CA-C 108.686 -1.766 . . . . 0.0 108.686 173.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -84.35 66.27 9.3 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 122.273 1.035 . . . . 0.0 111.554 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -67.63 -44.41 78.06 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 113.732 -1.576 . . . . 0.0 108.652 177.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 3.4 p -57.92 -38.89 76.71 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.478 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 47.7 tp -58.0 -52.82 63.91 Favored 'General case' 0 C--O 1.247 0.949 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.237 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.406 ' OE1' ' HB3' ' B' ' 105' ' ' HIS . 10.5 pt20 -72.44 -41.77 65.77 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 123.523 0.515 . . . . 0.0 112.044 -178.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -57.31 -55.45 34.62 Favored 'General case' 0 CA--C 1.498 -1.043 0 CA-C-O 121.534 0.683 . . . . 0.0 109.486 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.481 HD23 ' OE1' ' A' ' 78' ' ' GLU . 26.6 tp -69.62 -26.15 64.29 Favored 'General case' 0 C--O 1.183 -2.433 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.563 -175.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 35.8 tp -70.96 -36.05 72.41 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-N 118.926 0.785 . . . . 0.0 109.995 175.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 31.5 m -64.93 -36.13 83.4 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 16.1 m -76.66 -36.3 57.42 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.972 176.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.67 -36.59 72.11 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 125.327 1.451 . . . . 0.0 110.491 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 22.1 m -63.97 -10.4 21.22 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.598 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 64.8 tp -65.66 -57.65 7.6 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 3.4 p -77.52 -45.49 25.29 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.852 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 76.7 t60 71.95 -56.4 0.64 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.075 1.35 . . . . 0.0 110.582 -176.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 13.9 t -117.53 150.09 39.54 Favored 'General case' 0 N--CA 1.419 -2.016 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 32.7 t70 78.44 128.85 0.05 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 125.388 1.475 . . . . 0.0 111.901 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -157.35 -155.1 7.35 Favored Glycine 0 C--O 1.246 0.892 0 N-CA-C 111.579 -0.608 . . . . 0.0 111.579 -178.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -123.03 174.84 16.51 Favored Glycine 0 N--CA 1.44 -1.055 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.833 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -176.81 91.45 0.08 OUTLIER Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 68.1 m -157.07 173.0 17.66 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -114.93 -130.64 4.9 Favored Glycine 0 N--CA 1.424 -2.107 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 177.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -154.57 -119.48 0.7 Allowed Glycine 0 N--CA 1.424 -2.117 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 162.84 -135.44 3.84 Favored Glycine 0 C--N 1.299 -1.48 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 34.5 p -148.48 103.86 3.45 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -127.89 163.95 21.39 Favored Glycine 0 N--CA 1.433 -1.511 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.866 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 175.73 152.91 9.85 Favored Glycine 0 N--CA 1.434 -1.496 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 178.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 160.32 -54.97 0.33 Allowed Glycine 0 C--N 1.311 -0.845 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.441 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 23.1 t -157.17 147.67 21.25 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.023 -1.843 . . . . 0.0 106.023 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.637 ' O ' ' HB3' ' B' ' 141' ' ' MET . 1.5 pt? -105.85 -58.12 1.95 Allowed 'General case' 0 C--O 1.201 -1.48 0 C-N-CA 120.155 -0.618 . . . . 0.0 112.574 -178.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -83.9 -17.09 41.92 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 -174.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 58.1 m -74.71 -60.34 2.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 120.327 -0.549 . . . . 0.0 109.589 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -145.12 109.39 4.87 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 174.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.637 ' HB3' ' O ' ' B' ' 137' ' ' LEU . 24.4 ptp -102.39 -33.07 9.69 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.254 -172.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -17.98 -70.28 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 127.524 2.33 . . . . 0.0 115.84 -172.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 50.1 m -72.94 -38.66 66.73 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 120.94 0.4 . . . . 0.0 111.373 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 78.9 mt -65.97 -53.4 38.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.196 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 19.8 tt -65.55 -31.69 54.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.139 -177.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -59.93 -51.22 70.62 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.8 p -69.41 -39.33 77.99 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -80.95 -52.91 6.92 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.485 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 7.3 tt -96.39 -17.77 20.39 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.869 -171.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.472 ' HB2' ' CD2' ' A' ' 73' ' ' TYR . 26.4 ttt 79.72 111.54 0.07 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 122.166 0.984 . . . . 0.0 111.213 -177.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -110.51 -60.69 1.78 Allowed 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.376 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 C-N-CA 127.364 2.266 . . . . 0.0 105.1 179.084 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.932 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -88.62 135.48 25.6 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.224 0 CA-C-N 117.538 0.669 . . . . 0.0 110.116 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -84.68 102.29 12.85 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 120.952 0.405 . . . . 0.0 111.725 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.588 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 15.6 ptpt -152.35 88.36 1.36 Allowed 'General case' 0 N--CA 1.422 -1.85 0 CA-C-O 121.98 0.895 . . . . 0.0 111.883 175.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.19 -2.97 10.24 Favored Glycine 0 CA--C 1.508 -0.355 0 CA-C-N 114.197 -1.365 . . . . 0.0 114.907 -175.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.588 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 63.7 p-90 -68.35 -11.83 60.17 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 117.391 0.595 . . . . 0.0 110.771 176.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -60.75 -25.15 66.28 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.237 0.541 . . . . 0.0 110.345 176.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -77.69 -4.51 46.49 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 121.141 0.496 . . . . 0.0 110.64 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.7 m-70 -111.61 10.6 21.15 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 121.167 0.508 . . . . 0.0 110.664 -177.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.7 p -138.71 110.39 5.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 CA-C-O 122.043 0.925 . . . . 0.0 109.261 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.9 m -81.3 156.23 25.63 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.031 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -37.96 55.09 Favored 'General case' 0 C--O 1.204 -1.338 0 C-N-CA 124.23 1.012 . . . . 0.0 110.509 176.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -60.54 -38.42 84.43 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.526 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -69.87 -50.0 46.8 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 -176.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.577 ' O ' HG21 ' A' ' 19' ' ' VAL . 0.9 OUTLIER -65.23 -46.39 80.81 Favored 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 114.362 -1.29 . . . . 0.0 112.888 -177.894 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.8 t -66.4 -26.7 67.37 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.015 0.436 . . . . 0.0 110.03 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 10.2 t60 -64.8 -49.81 69.23 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 176.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.526 HD13 ' O ' ' A' ' 14' ' ' LEU . 4.5 mp -63.7 -39.46 94.37 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.197 177.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.577 HG21 ' O ' ' A' ' 15' ' ' ARG . 65.8 t -58.35 -51.85 66.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 124.077 0.951 . . . . 0.0 110.897 175.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -54.28 -45.42 72.47 Favored 'General case' 0 C--O 1.254 1.303 0 C-N-CA 123.705 0.802 . . . . 0.0 110.482 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -66.78 -39.56 87.85 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.901 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.499 ' O ' HG23 ' A' ' 26' ' ' ILE . 30.1 mt -51.14 -50.58 58.62 Favored 'General case' 0 CA--C 1.5 -0.977 0 O-C-N 123.76 0.663 . . . . 0.0 109.963 175.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.424 HG12 ' HE1' ' A' ' 40' ' ' MET . 73.8 t -54.19 -53.47 28.79 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.89 0 O-C-N 124.285 0.99 . . . . 0.0 110.353 176.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -51.91 -37.41 52.41 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -178.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.16 -46.31 13.95 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 178.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.499 HG23 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -75.92 -21.97 15.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.856 0.836 . . . . 0.0 110.422 -174.256 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.464 ' CG ' HD21 ' A' ' 43' ' ' LEU . 42.2 m-85 -133.98 89.72 28.51 Favored Pre-proline 0 N--CA 1.412 -2.333 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.412 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -59.76 100.47 0.14 Allowed 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.019 1.813 . . . . 0.0 110.383 176.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -67.84 138.04 92.79 Favored Pre-proline 0 N--CA 1.428 -1.545 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.762 -172.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.518 ' HB3' ' O ' ' B' ' 121' ' ' SER . 18.6 Cg_endo -64.34 -30.38 63.29 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.825 2.35 . . . . 0.0 111.832 178.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.508 ' HB2' ' O ' ' B' ' 124' ' ' ASP . 22.2 t70 -161.79 150.03 12.46 Favored Pre-proline 0 CA--C 1.503 -0.838 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 -176.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.406 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 7.6 Cg_endo -54.73 -25.05 40.44 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 122.579 2.186 . . . . 0.0 113.717 174.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.96 -11.72 59.84 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 121.21 -0.931 . . . . 0.0 112.029 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.69 -9.38 59.8 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.761 0.791 . . . . 0.0 109.258 177.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.414 ' O ' ' HG2' ' A' ' 40' ' ' MET . 22.6 mt -87.84 -0.07 56.48 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.711 -178.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.515 ' HB3' ' HZ1' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -133.86 15.3 3.94 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.967 0.889 . . . . 0.0 110.205 178.027 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.637 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 30.9 t70 -94.25 179.73 5.21 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.16 -178.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.637 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.7 -25.15 62.83 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 120.591 0.234 . . . . 0.0 110.75 177.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.623 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 15.4 tpp180 -57.87 -34.65 69.98 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 174.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.74 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.7 tpp -60.38 -36.98 79.35 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-N 114.613 -1.176 . . . . 0.0 113.133 -178.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.8 pt-20 -62.65 -31.43 72.3 Favored 'General case' 0 C--O 1.202 -1.431 0 C-N-CA 118.528 -1.269 . . . . 0.0 110.165 -177.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.405 HD21 HD23 ' A' ' 43' ' ' LEU . 6.3 t30 -74.23 -47.42 35.35 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-O 121.77 0.795 . . . . 0.0 110.099 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 20.4 mt -63.54 -46.46 85.89 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.704 -177.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.74 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.2 p -71.86 -27.86 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.534 -178.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.436 ' HB1' ' O ' ' A' ' 41' ' ' GLU . . . -58.9 -47.6 84.41 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.512 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.9 t80 -60.09 -46.26 90.18 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.23 173.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.15 97.83 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.367 -176.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -65.09 -39.36 93.07 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 123.603 0.761 . . . . 0.0 111.629 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.7 pttp -70.96 -38.54 72.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.527 0.68 . . . . 0.0 109.923 -177.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.475 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 42.8 t -73.66 -43.2 54.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.915 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 tm-20 -59.44 -45.3 91.98 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.88 -41.37 94.14 Favored Glycine 0 C--O 1.221 -0.696 0 O-C-N 123.663 0.602 . . . . 0.0 112.281 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.9 -54.34 48.06 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.104 0.562 . . . . 0.0 111.195 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -67.24 -34.13 76.81 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -62.37 -43.37 98.98 Favored 'General case' 0 C--O 1.2 -1.521 0 C-N-CA 123.754 0.822 . . . . 0.0 109.083 176.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -81.6 -15.29 55.17 Favored 'General case' 0 C--N 1.311 -1.076 0 O-C-N 121.414 -0.804 . . . . 0.0 112.035 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.5 t -85.43 -44.37 12.8 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 122.264 -0.273 . . . . 0.0 111.716 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.94 163.63 24.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 -175.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -105.59 -2.42 23.52 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.686 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.2 m -153.5 157.71 40.23 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.8 -34.75 69.62 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 119.885 -0.726 . . . . 0.0 111.113 177.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -62.06 -39.28 91.86 Favored 'General case' 0 C--O 1.205 -1.245 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -65.35 -48.48 72.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.535 177.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -44.96 92.35 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 123.434 0.459 . . . . 0.0 110.197 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -60.53 -44.76 95.72 Favored 'General case' 0 C--O 1.208 -1.088 0 O-C-N 123.829 0.706 . . . . 0.0 110.249 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -58.8 -55.78 30.64 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.326 0.65 . . . . 0.0 111.03 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.4 -33.72 75.76 Favored 'General case' 0 C--O 1.249 1.061 0 CA-C-O 121.058 0.456 . . . . 0.0 112.096 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.514 HD21 HD21 ' A' ' 18' ' ' LEU . 1.1 pp -74.98 -32.39 61.67 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.427 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -63.44 -39.54 94.75 Favored 'General case' 0 C--O 1.21 -1.001 0 CA-C-N 115.296 -0.866 . . . . 0.0 109.573 176.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -63.43 -46.22 87.32 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.903 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.491 ' O ' HD12 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.01 -40.75 78.51 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.746 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.483 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -65.13 -44.83 95.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.285 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.429 ' CE1' ' HE2' ' A' ' 77' ' ' LYS . 41.8 t80 -56.54 -49.59 74.35 Favored 'General case' 0 C--O 1.264 1.817 0 C-N-CA 124.823 1.249 . . . . 0.0 110.876 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.422 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.4 ptpt -66.76 -33.25 75.21 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.898 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.491 HD12 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -64.29 -39.58 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 176.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 34.0 mt-30 -63.15 -46.03 89.12 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.294 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.586 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -68.83 -31.04 69.74 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 118.901 -1.12 . . . . 0.0 113.507 177.995 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.5 tp10 -61.2 -52.33 65.26 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.485 HD13 ' N ' ' A' ' 80' ' ' GLU . 4.6 pp -61.46 -43.59 98.6 Favored 'General case' 0 C--O 1.243 0.734 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -177.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.485 ' N ' HD13 ' A' ' 79' ' ' LEU . 11.4 pt-20 -69.7 -44.03 71.22 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 119.697 -0.801 . . . . 0.0 112.358 -177.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.586 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -73.47 -32.91 64.58 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.504 -178.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.594 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -66.49 -40.54 89.33 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.22 179.214 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.594 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 19.9 tpp180 -77.93 -25.1 48.14 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.912 -178.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 32.9 ttm180 -95.01 -58.55 2.12 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.2 m -160.39 102.02 1.38 Allowed 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -172.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.463 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 3.2 ptp180 -164.6 -33.2 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 123.198 0.599 . . . . 0.0 110.636 168.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 49.3 mt . . . . . 0 C--O 1.246 0.921 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -178.525 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.063 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 15.0 m -73.3 112.3 9.24 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 14.5 tpt -79.28 -30.1 42.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.564 0.697 . . . . 0.0 109.55 -177.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' SER . . . . . 0.416 ' HB3' ' H ' ' B' ' 108' ' ' ASN . 27.3 m -93.39 100.4 12.72 Favored 'General case' 0 N--CA 1.418 -2.027 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.427 177.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -84.99 101.41 12.35 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 65.65 -0.02 1.35 Allowed 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 114.865 1.431 . . . . 0.0 114.865 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.32 -81.89 0.83 Allowed Glycine 0 N--CA 1.429 -1.772 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 175.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.416 ' H ' ' HB3' ' B' ' 104' ' ' SER . 94.7 m-20 -98.8 79.99 2.47 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.774 0.797 . . . . 0.0 112.067 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -83.57 -42.71 16.48 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.345 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 28.7 m -59.51 -47.19 86.49 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-N 114.527 -1.215 . . . . 0.0 111.358 -176.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 63.4 tp -54.15 -50.92 65.87 Favored 'General case' 0 C--O 1.21 -0.98 0 O-C-N 123.897 0.748 . . . . 0.0 111.77 -178.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -71.61 -41.15 69.26 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -174.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.01 -40.54 65.1 Favored 'General case' 0 C--O 1.246 0.873 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.449 -178.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 42.9 tp -72.34 -23.08 61.09 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.412 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.8 tp -66.43 -41.39 89.28 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 172.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 28.7 m -58.96 -41.93 88.69 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.2 m -66.66 -41.11 88.69 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-O 121.301 0.572 . . . . 0.0 111.154 175.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.3 -31.77 72.41 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.26 1.024 . . . . 0.0 110.347 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 19.8 m -77.25 -16.65 58.93 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.628 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . 0.476 ' O ' HD21 ' B' ' 120' ' ' LEU . 6.8 tt -87.26 -21.98 25.46 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' SER . . . . . 0.518 ' O ' ' HB3' ' A' ' 30' ' ' PRO . 9.4 t -57.8 -57.82 11.1 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.974 -175.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 63.5 m80 67.28 -48.08 0.49 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.332 1.053 . . . . 0.0 113.817 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 32.7 m 77.34 95.63 0.06 Allowed 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.181 1.793 . . . . 0.0 109.209 -174.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . 0.508 ' O ' ' HB2' ' A' ' 31' ' ' ASP . 19.9 t70 -148.14 128.59 13.99 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 -176.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -97.84 147.4 18.59 Favored Glycine 0 C--N 1.306 -1.096 0 N-CA-C 115.259 0.864 . . . . 0.0 115.259 -171.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -140.3 -52.99 0.04 OUTLIER Glycine 0 C--N 1.3 -1.465 0 N-CA-C 108.837 -1.705 . . . . 0.0 108.837 177.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 96.96 122.98 4.41 Favored Glycine 0 N--CA 1.427 -1.904 0 N-CA-C 114.259 0.463 . . . . 0.0 114.259 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 62.4 m -163.33 169.28 19.3 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 124.467 1.107 . . . . 0.0 110.002 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -92.4 -118.03 2.45 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 110.927 -0.869 . . . . 0.0 110.927 177.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.13 145.31 6.84 Favored Glycine 0 C--N 1.306 -1.134 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -144.97 144.08 12.72 Favored Glycine 0 C--N 1.306 -1.119 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.036 -178.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 33.7 m -134.01 114.32 13.09 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -160.08 169.19 35.93 Favored Glycine 0 N--CA 1.432 -1.617 0 N-CA-C 110.364 -1.095 . . . . 0.0 110.364 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . 0.457 ' C ' ' HG2' ' B' ' 138' ' ' GLU . . . 89.53 162.13 38.13 Favored Glycine 0 N--CA 1.432 -1.571 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . 0.432 ' N ' ' HG2' ' B' ' 138' ' ' GLU . . . 141.46 -129.71 4.12 Favored Glycine 0 N--CA 1.417 -2.602 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.995 179.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 5.1 m -139.57 -50.74 0.51 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.018 0.913 . . . . 0.0 109.076 -177.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 40.0 mt -79.99 -13.82 59.04 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.663 1.185 . . . . 0.0 110.059 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.595 ' HA ' ' SD ' ' B' ' 141' ' ' MET . 0.0 OUTLIER -56.0 -13.06 1.69 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 116.891 2.182 . . . . 0.0 116.891 -172.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 54.8 m -49.39 -51.34 35.57 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.384 0.674 . . . . 0.0 112.086 -175.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -154.43 74.58 0.96 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 172.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.595 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 24.4 ptm -101.96 -21.26 14.54 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.481 -175.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -37.89 -54.9 1.25 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 117.405 2.372 . . . . 0.0 117.405 -175.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 16.2 t -71.26 -30.81 66.75 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 119.749 -0.781 . . . . 0.0 110.317 -177.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 49.1 mm -74.82 -44.5 45.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.708 -179.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 18.5 tt -69.11 -31.32 49.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 CA-C-O 120.754 0.312 . . . . 0.0 110.248 -179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.473 ' HD3' ' O ' ' B' ' 150' ' ' MET . 4.0 tpp180 -63.4 -61.51 2.3 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 173.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 40.3 t -55.01 -53.76 51.66 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.575 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -81.93 -46.1 14.5 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -172.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.427 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 10.4 tt -93.17 -34.67 13.52 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -169.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.473 ' O ' ' HD3' ' B' ' 146' ' ' ARG . 26.1 ptm -169.95 110.07 0.41 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 118.561 -1.256 . . . . 0.0 113.253 -174.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -87.56 151.26 23.13 Favored 'General case' 0 C--N 1.285 -2.216 0 CA-C-N 114.465 -1.243 . . . . 0.0 109.875 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.249 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 -179.152 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.832 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 33.8 m -132.95 152.89 36.85 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.697 0 CA-C-O 121.736 0.779 . . . . 0.0 112.264 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.45 ' O ' ' HG2' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -114.76 102.52 10.09 Favored 'General case' 0 N--CA 1.413 -2.307 0 N-CA-C 103.183 -2.895 . . . . 0.0 103.183 170.405 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.449 ' HD3' ' NE1' ' A' ' 6' ' ' TRP . 13.4 ptpt -84.22 99.48 10.57 Favored 'General case' 0 C--N 1.286 -2.194 0 C-N-CA 119.66 -0.816 . . . . 0.0 113.022 -171.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.45 -14.59 28.18 Favored Glycine 0 C--O 1.238 0.367 0 CA-C-N 113.762 -1.563 . . . . 0.0 115.079 -175.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.533 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 69.4 p-90 -73.69 -3.01 25.65 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 122.242 -0.564 . . . . 0.0 111.992 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -62.91 -24.0 67.63 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 121.153 0.502 . . . . 0.0 110.971 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -79.19 -20.75 47.61 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.572 0.701 . . . . 0.0 109.786 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.533 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 13.4 m-70 -90.29 2.84 55.07 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.649 -1.159 . . . . 0.0 110.116 -174.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.458 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.4 p -132.64 123.86 50.09 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.774 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 m -87.81 154.4 20.57 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.874 -175.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.5 -43.25 75.47 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 172.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -62.08 -32.59 73.15 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.499 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.483 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.4 tm? -73.24 -52.15 15.07 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 -177.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.548 ' O ' HG21 ' A' ' 19' ' ' VAL . 5.4 ptm180 -63.79 -42.74 97.67 Favored 'General case' 0 N--CA 1.425 -1.698 0 CA-C-N 114.618 -1.174 . . . . 0.0 112.844 -178.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.1 t -65.66 -33.53 76.1 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.242 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -64.24 -44.41 91.91 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.499 HD21 HD22 ' A' ' 68' ' ' LEU . 4.8 mp -64.82 -39.45 93.61 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.235 178.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.548 HG21 ' O ' ' A' ' 15' ' ' ARG . 65.1 t -58.32 -51.04 76.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.512 0.725 . . . . 0.0 110.01 174.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.421 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 16.4 t-80 -51.98 -47.27 64.92 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 124.23 1.012 . . . . 0.0 110.503 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.475 ' HD3' ' CD2' ' B' ' 149' ' ' LEU . 40.3 mttm -68.71 -41.14 79.52 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.593 178.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.482 ' O ' HG22 ' A' ' 26' ' ' ILE . 31.6 mt -51.32 -50.27 59.73 Favored 'General case' 0 CA--C 1.501 -0.923 0 O-C-N 123.931 0.769 . . . . 0.0 109.743 175.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.2 t -53.69 -53.78 23.74 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.577 0 O-C-N 124.549 1.155 . . . . 0.0 110.199 175.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 97.9 mt-30 -51.14 -39.38 56.14 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -177.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.71 -46.35 14.4 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.487 HG21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.03 -23.8 17.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.881 0.848 . . . . 0.0 109.674 -174.637 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.523 ' CG ' HD21 ' A' ' 43' ' ' LEU . 50.6 m-85 -136.65 87.99 20.01 Favored Pre-proline 0 N--CA 1.408 -2.558 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.014 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.475 ' O ' ' HB2' ' B' ' 121' ' ' SER . 9.6 Cg_endo -55.56 113.36 1.39 Allowed 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 121.583 1.522 . . . . 0.0 109.426 174.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -77.1 137.23 65.31 Favored Pre-proline 0 N--CA 1.42 -1.971 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.725 -176.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.562 ' HA ' ' O ' ' B' ' 123' ' ' SER . 71.6 Cg_endo -73.43 -25.72 15.01 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.937 2.424 . . . . 0.0 111.814 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -151.97 144.41 16.74 Favored Pre-proline 0 CA--C 1.497 -1.087 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -177.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -60.25 -22.96 72.59 Favored 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.115 1.876 . . . . 0.0 113.131 175.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.55 -3.26 57.51 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 121.348 -0.845 . . . . 0.0 111.095 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.418 ' HA ' ' HB2' ' A' ' 37' ' ' ASP . . . -80.15 -9.94 59.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 173.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.447 ' HA ' ' CE ' ' A' ' 40' ' ' MET . 20.2 mt -88.44 6.75 36.09 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.611 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -136.06 12.28 3.34 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-O 121.937 0.875 . . . . 0.0 109.159 173.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.675 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 23.1 t70 -91.83 -179.82 5.42 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 114.416 -1.265 . . . . 0.0 110.614 -170.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.675 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.66 -26.86 62.71 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-O 121.02 0.438 . . . . 0.0 110.526 175.608 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.656 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -66.23 -30.07 70.44 Favored 'General case' 0 C--O 1.247 0.932 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 174.696 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.574 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.98 -40.85 90.51 Favored 'General case' 0 C--O 1.193 -1.884 0 CA-C-O 118.476 -0.773 . . . . 0.0 110.976 -179.004 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.2 pt-20 -61.49 -31.8 71.8 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.507 -174.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.423 HD21 HD23 ' A' ' 43' ' ' LEU . 5.5 t30 -75.68 -43.23 48.38 Favored 'General case' 0 C--O 1.262 1.76 0 CA-C-O 121.479 0.656 . . . . 0.0 110.57 176.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.656 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 17.9 mt -64.14 -47.29 80.52 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.261 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.574 HG22 ' O ' ' A' ' 40' ' ' MET . 27.7 m -69.37 -30.63 46.43 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.05 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.082 178.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.26 -50.42 69.54 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 175.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.1 t80 -59.68 -48.37 81.95 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.444 174.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.69 -38.39 87.65 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 120.552 -0.459 . . . . 0.0 112.085 -175.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 62.9 mttm -67.07 -45.81 76.2 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 123.036 0.535 . . . . 0.0 110.665 177.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -64.03 -38.14 89.98 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.485 0.66 . . . . 0.0 110.139 -177.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.482 HG22 ' CZ ' ' A' ' 46' ' ' TYR . 50.0 t -73.1 -44.07 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.836 179.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -58.3 -45.63 87.62 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 177.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.76 -42.24 97.92 Favored Glycine 0 CA--C 1.503 -0.714 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.153 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.439 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 27.0 t70 -55.06 -54.37 43.93 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 123.026 0.53 . . . . 0.0 111.26 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.438 ' HB2' HD12 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -70.39 -30.35 67.23 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -179.611 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -62.32 -48.51 79.52 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 176.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -73.74 -24.24 59.87 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.519 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -75.03 -31.93 61.45 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-O 121.417 0.627 . . . . 0.0 110.037 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.56 167.09 12.83 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 121.683 0.754 . . . . 0.0 112.977 -175.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -118.5 11.35 12.9 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.97 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.3 p -164.76 156.22 15.27 Favored 'General case' 0 N--CA 1.421 -1.917 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.458 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.14 -28.16 63.08 Favored 'General case' 0 C--O 1.202 -1.404 0 C-N-CA 119.447 -0.901 . . . . 0.0 111.065 179.756 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -61.34 -47.79 84.26 Favored 'General case' 0 C--O 1.211 -0.925 0 O-C-N 123.66 0.6 . . . . 0.0 109.581 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.453 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 5.1 tp10 -60.93 -48.97 79.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.257 177.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -46.41 81.99 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.031 -175.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -62.66 -41.23 98.95 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 123.542 0.526 . . . . 0.0 109.742 176.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 -60.05 -57.54 12.39 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.131 0.572 . . . . 0.0 112.244 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.482 HD11 ' N ' ' A' ' 68' ' ' LEU . 3.6 pp -66.57 -32.08 73.19 Favored 'General case' 0 C--O 1.252 1.206 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -174.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.499 HD22 HD21 ' A' ' 18' ' ' LEU . 1.0 OUTLIER -75.86 -31.42 59.27 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.44 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.437 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -65.2 -34.39 78.26 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.77 175.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -68.82 -44.36 73.66 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.393 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.1 -39.08 86.65 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.174 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.45 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 7.2 tt -66.54 -44.3 90.25 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.47 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.224 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.448 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 54.4 t80 -55.36 -51.64 66.14 Favored 'General case' 0 C--O 1.255 1.386 0 C-N-CA 124.741 1.217 . . . . 0.0 111.022 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.87 -34.64 78.88 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.676 -178.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.15 -38.53 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.897 178.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.51 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 33.4 mt-30 -66.69 -41.57 87.84 Favored 'General case' 0 CA--C 1.509 -0.611 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.075 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.6 OUTLIER -71.7 -28.27 63.59 Favored 'General case' 0 N--CA 1.424 -1.741 0 C-N-CA 118.936 -1.106 . . . . 0.0 113.541 176.199 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -66.57 -42.3 87.26 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.558 ' O ' ' HB2' ' A' ' 83' ' ' ARG . 4.6 pp -65.83 -46.09 79.83 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.957 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 16.9 pt-20 -68.93 -35.36 76.71 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 119.246 -0.981 . . . . 0.0 111.904 -177.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.9 pt-20 -68.53 -42.08 78.98 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 120.039 -0.665 . . . . 0.0 111.168 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.628 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -70.02 -33.66 72.28 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.494 0.664 . . . . 0.0 110.761 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.628 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 26.5 ttt180 -77.56 -34.38 53.74 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.945 -172.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 59.3 ttt180 -108.05 -59.0 1.91 Allowed 'General case' 0 N--CA 1.438 -1.073 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.7 m -157.88 92.12 1.17 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -171.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -142.15 -21.59 0.7 Allowed 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.889 165.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.243 0.742 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 171.072 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.83 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 30.9 t -73.53 -31.7 63.81 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -70.05 -23.13 63.04 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.406 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 8.5 t -89.11 79.33 7.22 Favored 'General case' 0 N--CA 1.418 -2.026 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -74.66 -22.52 58.84 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 113.935 -1.484 . . . . 0.0 111.718 -176.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 58.58 84.24 0.11 Allowed 'General case' 0 C--O 1.24 0.579 0 CA-C-O 122.656 1.217 . . . . 0.0 112.243 -174.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 142.9 -44.88 0.94 Allowed Glycine 0 N--CA 1.416 -2.672 0 CA-C-N 112.721 -2.036 . . . . 0.0 108.671 -175.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -112.95 14.25 19.68 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -73.29 -11.86 60.65 Favored 'General case' 0 N--CA 1.483 1.194 0 O-C-N 121.41 -0.806 . . . . 0.0 110.154 179.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 25.6 p -59.01 -28.75 66.68 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.31 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 37.4 tp -56.23 -58.02 9.72 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.83 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.412 ' HA ' ' HB3' ' B' ' 115' ' ' LEU . 20.5 pt20 -76.01 -25.26 55.54 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.677 -177.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.08 -47.62 79.39 Favored 'General case' 0 C--O 1.254 1.293 0 CA-C-O 122.087 0.946 . . . . 0.0 108.968 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 26.3 tp -71.94 -27.34 62.73 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.41 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.552 HD23 ' NZ ' ' A' ' 82' ' ' LYS . 2.9 tm? -67.43 -35.93 80.22 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 172.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 47.0 m -62.7 -37.43 86.44 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 177.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.49 ' O ' ' HG ' ' B' ' 120' ' ' LEU . 13.3 m -66.58 -49.54 66.05 Favored 'General case' 0 CA--C 1.557 1.219 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.509 173.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -55.67 -36.52 67.19 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.251 1.021 . . . . 0.0 111.149 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 41.7 m -66.25 -18.3 65.27 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.671 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' B' ' 117' ' ' SER . 3.2 pp -95.57 -20.93 18.59 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.314 -0.954 . . . . 0.0 110.129 175.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' SER . . . . . 0.475 ' HB2' ' O ' ' A' ' 28' ' ' PRO . 32.5 t -77.33 -60.78 2.22 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.799 -177.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 58.72 -69.74 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 124.368 1.067 . . . . 0.0 110.617 -169.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' SER . . . . . 0.562 ' O ' ' HA ' ' A' ' 30' ' ' PRO . 42.5 m -101.05 150.56 22.78 Favored 'General case' 0 N--CA 1.427 -1.616 0 C-N-CA 124.352 1.061 . . . . 0.0 108.674 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -99.67 128.05 45.77 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-O 120.827 0.346 . . . . 0.0 110.864 -176.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -88.16 -19.21 53.83 Favored Glycine 0 N--CA 1.438 -1.193 0 C-N-CA 120.894 -0.669 . . . . 0.0 111.76 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 76.08 -157.95 49.02 Favored Glycine 0 N--CA 1.443 -0.887 0 N-CA-C 111.251 -0.739 . . . . 0.0 111.251 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 148.91 86.87 0.06 OUTLIER Glycine 0 N--CA 1.436 -1.333 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.628 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 36.5 m -69.01 122.59 19.0 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 120.795 0.331 . . . . 0.0 110.108 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -114.77 108.79 2.02 Favored Glycine 0 N--CA 1.43 -1.76 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.016 -178.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -162.45 -127.61 0.89 Allowed Glycine 0 N--CA 1.433 -1.521 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 76.81 -142.78 28.16 Favored Glycine 0 N--CA 1.431 -1.694 0 C-N-CA 120.778 -0.725 . . . . 0.0 111.407 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 11.6 p -153.99 126.48 8.05 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 -178.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . 0.442 ' HA3' ' HG2' ' B' ' 138' ' ' GLU . . . -85.44 -69.89 1.34 Allowed Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.029 -1.082 . . . . 0.0 111.61 178.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 118.19 56.73 0.28 Allowed Glycine 0 C--O 1.248 1.018 0 C-N-CA 120.046 -1.073 . . . . 0.0 112.548 176.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -145.39 -46.89 0.04 OUTLIER Glycine 0 N--CA 1.425 -2.09 0 C-N-CA 121.497 -0.382 . . . . 0.0 112.492 178.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 29.3 p -161.02 -80.29 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 67.6 mt -92.2 -37.02 12.94 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.383 0.611 . . . . 0.0 111.22 -174.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.442 ' HG2' ' HA3' ' B' ' 133' ' ' GLY . 0.0 OUTLIER -67.23 -12.95 61.44 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -170.274 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 37.6 t -73.72 -36.63 65.23 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.746 -178.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -135.87 70.12 1.43 Allowed 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.59 0.709 . . . . 0.0 110.841 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.459 ' HB3' ' HB ' ' B' ' 145' ' ' ILE . 63.6 mtm -103.32 -55.17 2.45 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.491 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 8.57 -73.63 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 127.651 2.381 . . . . 0.0 117.147 -174.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 7.0 p -70.56 -44.76 66.77 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-O 121.544 0.688 . . . . 0.0 111.618 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 69.7 mt -62.32 -53.63 44.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.228 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.459 ' HB ' ' HB3' ' B' ' 141' ' ' MET . 16.2 tt -64.66 -31.3 53.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.822 -176.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' B' ' 150' ' ' MET . 29.6 ttt180 -63.36 -54.44 36.92 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 39.0 t -67.09 -41.75 85.8 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.222 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -79.55 -53.91 6.41 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -174.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.475 ' CD2' ' HD3' ' A' ' 21' ' ' LYS . 10.2 tt -98.72 -10.05 23.7 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -175.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.477 ' HA ' ' O ' ' B' ' 146' ' ' ARG . 23.8 ttt 81.53 151.37 0.1 Allowed 'General case' 0 C--O 1.251 1.182 0 CA-C-O 121.9 0.857 . . . . 0.0 112.577 173.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -146.22 -171.6 3.76 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 -175.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.312 -1.032 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -178.064 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.034 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.5 m -108.3 129.65 62.26 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-N 117.339 0.57 . . . . 0.0 110.526 178.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -104.55 88.98 3.07 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-O 121.854 0.835 . . . . 0.0 111.873 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -138.96 106.21 5.5 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 113.861 -1.518 . . . . 0.0 108.893 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.46 -14.35 8.99 Favored Glycine 0 N--CA 1.475 1.282 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 -170.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.2 p-90 -73.02 -11.69 60.65 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 117.535 0.667 . . . . 0.0 111.835 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.45 -18.39 50.98 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 121.248 0.547 . . . . 0.0 111.691 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -75.73 -21.73 57.23 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.301 0.572 . . . . 0.0 110.448 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -101.92 14.29 32.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.353 0.597 . . . . 0.0 111.631 -174.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.419 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 4.1 p -135.11 110.63 12.54 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.229 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.12 165.72 12.1 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.151 -0.931 . . . . 0.0 113.337 -176.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -36.13 76.21 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.669 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -71.8 -33.21 68.37 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.03 -0.668 . . . . 0.0 111.888 -176.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.53 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -66.81 -50.52 62.37 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.535 ' O ' HG21 ' A' ' 19' ' ' VAL . 5.3 ptm180 -67.92 -42.91 80.35 Favored 'General case' 0 N--CA 1.413 -2.279 0 CA-C-N 114.291 -1.322 . . . . 0.0 112.433 -177.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.1 t -63.96 -26.99 68.83 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.197 0.523 . . . . 0.0 110.277 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.497 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 8.5 t60 -65.62 -52.63 50.48 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 175.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.53 HD13 ' O ' ' A' ' 14' ' ' LEU . 4.4 mp -61.39 -42.66 99.08 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.356 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.535 HG21 ' O ' ' A' ' 15' ' ' ARG . 51.5 t -55.92 -50.32 69.74 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 C-N-CA 124.442 1.097 . . . . 0.0 110.487 175.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -55.33 -42.63 74.06 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 123.833 0.853 . . . . 0.0 110.477 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 46.6 mttm -69.58 -36.54 76.35 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.317 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.426 ' O ' HG22 ' A' ' 26' ' ' ILE . 83.5 mt -57.01 -42.1 79.7 Favored 'General case' 0 CA--C 1.518 -0.268 0 O-C-N 123.286 0.366 . . . . 0.0 110.022 175.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.416 ' HA ' HG22 ' A' ' 26' ' ' ILE . 55.7 t -56.88 -52.84 50.12 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.148 0 O-C-N 124.22 0.95 . . . . 0.0 110.533 171.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -54.65 -33.54 60.8 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.0 -43.95 18.84 Favored 'General case' 0 C--O 1.206 -1.195 0 CA-C-O 121.16 0.505 . . . . 0.0 111.856 177.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.426 HG22 ' O ' ' A' ' 22' ' ' LEU . 2.6 tt -73.72 -31.42 31.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 O-C-N 120.952 -1.092 . . . . 0.0 110.885 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -132.07 95.44 21.86 Favored Pre-proline 0 C--N 1.264 -3.144 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.176 -176.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -63.89 94.14 0.19 Allowed 'Trans proline' 0 C--N 1.358 1.034 0 C-N-CA 122.219 1.946 . . . . 0.0 110.556 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.405 ' OG1' ' HB2' ' A' ' 34' ' ' ALA . 14.6 t -62.94 132.56 95.01 Favored Pre-proline 0 N--CA 1.426 -1.649 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.383 -175.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HA ' ' HA3' ' B' ' 125' ' ' GLY . 29.8 Cg_endo -67.51 -33.14 29.88 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.7 2.267 . . . . 0.0 111.791 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -150.9 147.65 21.31 Favored Pre-proline 0 C--N 1.306 -1.289 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 -177.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -56.29 -17.87 22.3 Favored 'Trans proline' 0 CA--C 1.553 1.425 0 C-N-CA 122.507 2.138 . . . . 0.0 113.596 174.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.33 -6.02 59.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.696 -0.627 . . . . 0.0 112.193 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.405 ' HB2' ' OG1' ' A' ' 29' ' ' THR . . . -81.84 -11.35 58.99 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 122.138 0.971 . . . . 0.0 108.8 175.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.478 ' O ' ' HG2' ' A' ' 40' ' ' MET . 33.8 mt -84.91 4.51 33.11 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.233 -1.348 . . . . 0.0 110.472 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -133.22 17.36 4.08 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-O 121.863 0.84 . . . . 0.0 109.856 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.575 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 37.2 t70 -92.02 177.11 6.27 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.827 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.575 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.81 -26.84 63.48 Favored 'General case' 0 C--N 1.307 -1.248 0 O-C-N 122.28 -0.262 . . . . 0.0 110.409 176.478 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.582 ' O ' HD13 ' A' ' 43' ' ' LEU . 39.8 ttm180 -60.08 -35.81 76.0 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.719 0.771 . . . . 0.0 109.558 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.597 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.8 tpp -57.83 -32.27 67.44 Favored 'General case' 0 C--O 1.2 -1.509 0 CA-C-N 114.603 -1.18 . . . . 0.0 112.228 178.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 13.5 pt-20 -64.28 -32.37 73.93 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 118.551 -1.26 . . . . 0.0 110.299 -178.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -72.6 -45.28 59.84 Favored 'General case' 0 C--O 1.253 1.27 0 CA-C-O 122.277 1.037 . . . . 0.0 109.139 176.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 39' ' ' ARG . 3.0 mp -55.7 -56.33 21.76 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 113.551 -1.659 . . . . 0.0 110.165 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.597 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 2.7 p -70.28 -27.55 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.858 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.176 -176.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -57.6 -49.36 76.67 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.514 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.1 t80 -62.21 -45.55 92.85 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.083 175.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.22 -45.99 83.34 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.915 -177.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -63.88 -43.84 94.84 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 124.055 0.942 . . . . 0.0 112.857 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.514 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 59.1 pttt -64.09 -41.05 97.44 Favored 'General case' 0 C--O 1.251 1.163 0 CA-C-O 121.582 0.706 . . . . 0.0 110.175 -177.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.467 HG21 ' CE2' ' A' ' 46' ' ' TYR . 55.9 t -73.1 -45.04 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.163 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.9 tm-20 -58.06 -45.25 87.37 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 177.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.25 -43.15 93.7 Favored Glycine 0 N--CA 1.438 -1.203 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.111 178.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -58.53 -54.12 50.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.661 0.267 . . . . 0.0 111.495 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -65.77 -31.43 72.4 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -65.05 -38.74 91.83 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -82.09 -23.25 35.85 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 121.747 -0.596 . . . . 0.0 112.063 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -80.22 -40.95 26.1 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 123.047 0.539 . . . . 0.0 111.473 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.17 161.09 29.1 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -106.12 7.4 31.68 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.829 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.5 p -159.11 157.9 31.88 Favored 'General case' 0 CA--C 1.477 -1.849 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.419 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -72.48 -24.43 61.18 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.066 -1.053 . . . . 0.0 109.614 178.184 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -67.57 -47.48 69.66 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 115.088 -0.96 . . . . 0.0 108.499 177.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -60.36 -46.59 89.39 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.496 175.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -46.4 85.87 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 123.319 0.387 . . . . 0.0 110.631 -177.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -62.0 -44.67 96.24 Favored 'General case' 0 C--O 1.216 -0.707 0 O-C-N 123.643 0.59 . . . . 0.0 110.679 177.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -67.7 -43.13 80.85 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 pp -71.69 -35.18 70.17 Favored 'General case' 0 C--O 1.25 1.079 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.123 -177.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.501 HD23 HD23 ' A' ' 18' ' ' LEU . 1.3 pp -72.26 -33.68 67.67 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.47 ' HB1' ' O ' ' B' ' 148' ' ' GLU . . . -63.51 -39.63 94.93 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.03 176.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -62.15 -49.47 75.73 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.433 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -34.55 72.51 Favored 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.042 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.528 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 4.9 tt -70.88 -45.85 71.13 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.563 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -55.15 -50.75 68.48 Favored 'General case' 0 C--O 1.282 2.798 0 C-N-CA 124.665 1.186 . . . . 0.0 110.887 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -62.98 -39.5 94.91 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.629 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -62.44 -39.92 86.14 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.981 0 O-C-N 123.356 0.41 . . . . 0.0 111.861 177.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.612 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 22.1 mm-40 -57.75 -49.67 75.81 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 121.87 0.843 . . . . 0.0 109.637 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.45 -38.21 74.44 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.661 0.985 . . . . 0.0 113.661 178.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.33 -45.53 91.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 3.7 pp -64.25 -42.82 96.33 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.489 -177.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.447 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 4.7 mm-40 -68.9 -41.44 78.25 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -70.47 -35.03 73.06 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 119.464 -0.894 . . . . 0.0 111.438 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.53 -29.87 62.74 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.549 0.69 . . . . 0.0 109.788 178.009 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.526 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 4.9 tmm_? -76.96 -32.1 57.05 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.01 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.49 ' O ' ' HB2' ' A' ' 85' ' ' SER . 25.8 tpt180 -75.09 -59.29 2.81 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.364 174.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.49 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 20.4 t 158.1 111.81 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.302 1.441 . . . . 0.0 108.171 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.433 ' HG3' HD23 ' A' ' 87' ' ' LEU . 12.3 ptm180 -124.33 -19.97 5.35 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.776 172.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.433 HD23 ' HG3' ' A' ' 86' ' ' ARG . 4.3 mm? . . . . . 0 C--O 1.247 0.942 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 174.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 110.453 -1.059 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 17.3 t -114.87 104.62 12.11 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 117.493 0.647 . . . . 0.0 109.434 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 26.0 mmt -110.88 -22.94 11.28 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.203 0.525 . . . . 0.0 110.832 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 47.0 m -102.67 15.5 29.11 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.031 -179.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -159.38 129.97 5.85 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -154.11 -165.21 2.04 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.016 177.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.47 92.05 0.09 OUTLIER Glycine 0 C--N 1.308 -0.986 0 O-C-N 123.149 0.28 . . . . 0.0 113.775 -174.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 55.0 t30 65.03 40.59 5.05 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-O 121.844 0.83 . . . . 0.0 108.927 174.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -60.98 -24.23 65.96 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 176.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 3.4 m -55.08 -32.89 62.32 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 126.035 1.734 . . . . 0.0 111.486 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 59.8 tp -60.57 -54.98 38.84 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.035 0.445 . . . . 0.0 110.745 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -75.64 -27.45 58.4 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.591 -0.443 . . . . 0.0 111.113 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -63.41 -48.79 76.38 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 121.537 0.684 . . . . 0.0 109.728 175.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 31.8 tp -69.13 -27.97 66.04 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.285 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.19 -40.03 82.32 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 174.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 43.6 m -63.81 -39.53 94.46 Favored 'General case' 0 CA--C 1.552 1.021 0 CA-C-O 121.353 0.597 . . . . 0.0 109.402 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.1 t -68.44 -42.49 78.76 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.398 177.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -56.0 -45.85 78.9 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.898 1.679 . . . . 0.0 111.278 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 28.5 m -62.01 -28.3 69.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.195 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 7.1 tt -68.55 -37.46 79.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 23.8 m -76.23 -10.13 59.17 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.006 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 80.54 -39.57 0.16 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.022 1.729 . . . . 0.0 114.143 176.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 32.6 t -161.15 -77.58 0.05 Allowed 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.143 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -169.88 -177.87 2.76 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -172.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . 0.437 ' HA3' ' HA ' ' A' ' 30' ' ' PRO . . . -171.01 -114.15 0.31 Allowed Glycine 0 N--CA 1.434 -1.487 0 C-N-CA 120.245 -0.979 . . . . 0.0 112.527 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 163.79 163.1 15.88 Favored Glycine 0 N--CA 1.431 -1.638 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -178.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 157.16 35.57 0.02 OUTLIER Glycine 0 C--N 1.306 -1.129 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 34.0 m -68.95 153.94 42.92 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 122.784 0.434 . . . . 0.0 111.122 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 168.07 -169.32 41.34 Favored Glycine 0 N--CA 1.436 -1.329 0 C-N-CA 120.831 -0.7 . . . . 0.0 111.509 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -135.59 -104.92 0.78 Allowed Glycine 0 N--CA 1.433 -1.506 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 117.24 49.52 0.4 Allowed Glycine 0 C--N 1.305 -1.156 0 C-N-CA 121.189 -0.529 . . . . 0.0 112.686 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 65.2 m -67.32 134.5 51.66 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 178.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . 0.422 ' O ' ' HA ' ' B' ' 139' ' ' CYS . . . -121.74 -133.75 4.39 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -178.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -133.25 65.09 0.59 Allowed Glycine 0 C--N 1.305 -1.177 0 C-N-CA 120.157 -1.02 . . . . 0.0 112.312 -178.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -137.37 -156.88 7.41 Favored Glycine 0 C--N 1.311 -0.837 0 C-N-CA 120.428 -0.891 . . . . 0.0 112.362 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 9.1 m -46.06 -84.03 0.01 OUTLIER 'General case' 0 CA--C 1.566 1.571 0 C-N-CA 125.464 1.506 . . . . 0.0 114.474 -175.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 87.7 mt -97.43 -24.84 15.43 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -62.11 -12.03 17.33 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 127.187 2.195 . . . . 0.0 114.182 -176.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 133' ' ' GLY . 6.1 p -57.24 -59.54 4.96 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -139.67 96.86 3.15 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.436 ' HB3' ' HB ' ' B' ' 145' ' ' ILE . 69.3 mtp -97.76 -47.55 5.55 Favored 'General case' 0 C--N 1.292 -1.917 0 C-N-CA 119.486 -0.885 . . . . 0.0 110.423 -178.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 25.64 -84.13 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 127.853 2.461 . . . . 0.0 115.502 176.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.1 p -72.86 -47.1 48.96 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 114.55 -1.204 . . . . 0.0 111.216 -175.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 65.3 mt -63.79 -41.91 94.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.767 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.471 HG12 ' NE2' ' A' ' 17' ' ' HIS . 9.5 tp -66.19 -41.32 89.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.097 0 C-N-CA 119.617 -0.833 . . . . 0.0 110.693 -178.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -66.17 -57.08 8.4 Favored 'General case' 0 N--CA 1.436 -1.128 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.133 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 43.4 t -55.2 -53.96 49.41 Favored 'General case' 0 C--O 1.249 1.049 0 C-N-CA 123.757 0.823 . . . . 0.0 113.133 -176.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.47 ' O ' ' HB1' ' A' ' 69' ' ' ALA . 5.5 mm-40 -81.84 -42.25 19.89 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -172.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.416 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 1.5 tm? -81.19 -53.32 6.47 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.469 -0.493 . . . . 0.0 110.358 -173.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 4.9 ppp? -177.16 117.46 0.1 Allowed 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 121.436 0.636 . . . . 0.0 110.614 -178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -80.82 -41.3 23.53 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 175.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.401 -2.912 0 N-CA-C 102.047 -3.316 . . . . 0.0 102.047 178.656 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.518 0 N-CA-C 111.772 -0.531 . . . . 0.0 111.772 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.2 t -86.13 116.77 29.6 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.56 140.64 37.7 Favored 'General case' 0 N--CA 1.419 -1.997 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -177.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.489 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.6 ptpt -146.31 104.03 3.75 Favored 'General case' 0 C--N 1.266 -3.054 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.647 -178.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -74.02 -0.68 57.17 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 114.589 -1.187 . . . . 0.0 113.702 -175.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.489 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 52.2 p-90 -72.67 -7.74 51.86 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 117.57 0.685 . . . . 0.0 111.584 177.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.464 ' HB2' ' HH ' ' A' ' 55' ' ' TYR . 7.4 p80 -65.99 -9.61 31.84 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 9.7 pt-20 -88.13 -8.64 55.12 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.272 0.558 . . . . 0.0 110.027 174.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -94.98 9.89 37.67 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.533 0.682 . . . . 0.0 109.867 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.416 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.6 p -141.79 155.17 19.8 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.2 m -123.69 160.59 26.88 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.62 -36.1 71.34 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 120.903 0.382 . . . . 0.0 110.226 175.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.444 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 4.0 m-20 -63.68 -33.69 76.19 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.501 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.4 tm? -73.17 -51.13 19.01 Favored 'General case' 0 CA--C 1.498 -1.055 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 -177.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.513 ' O ' HG22 ' A' ' 19' ' ' VAL . 7.0 ptm180 -64.81 -44.18 90.75 Favored 'General case' 0 N--CA 1.423 -1.802 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.976 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.8 t -66.29 -29.17 69.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 18.2 t60 -65.18 -44.69 87.64 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.501 HD11 ' O ' ' A' ' 14' ' ' LEU . 3.7 mp -66.6 -39.64 88.48 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.338 177.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 15' ' ' ARG . 55.0 t -57.45 -51.9 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.842 0.857 . . . . 0.0 110.3 175.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -55.98 -45.78 78.86 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.314 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -65.84 -40.22 91.55 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.245 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.485 ' O ' HG23 ' A' ' 26' ' ' ILE . 28.7 mt -51.26 -50.29 59.52 Favored 'General case' 0 CA--C 1.498 -1.048 0 O-C-N 123.676 0.61 . . . . 0.0 109.543 174.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.9 t -53.92 -51.69 42.92 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.497 0 O-C-N 124.468 1.105 . . . . 0.0 110.528 175.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -55.77 -35.41 66.21 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -176.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.448 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -81.44 -45.58 15.84 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 177.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.485 HG23 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -77.72 -25.49 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 122.044 0.926 . . . . 0.0 110.565 -174.682 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.553 ' CG ' HD21 ' A' ' 43' ' ' LEU . 57.6 m-85 -131.44 98.07 18.77 Favored Pre-proline 0 C--N 1.278 -2.514 0 CA-C-N 115.289 -0.869 . . . . 0.0 108.732 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -49.51 133.63 31.83 Favored 'Trans proline' 0 CA--C 1.48 -2.183 0 C-N-CA 122.394 2.063 . . . . 0.0 111.209 177.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.1 m -91.28 116.8 67.17 Favored Pre-proline 1 N--CA 1.369 -4.505 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.374 -174.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -79.92 -30.42 2.27 Favored 'Trans proline' 0 C--N 1.323 -0.78 0 C-N-CA 122.088 1.858 . . . . 0.0 111.255 176.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -147.84 147.43 27.03 Favored Pre-proline 0 CA--C 1.488 -1.431 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -69.2 -12.02 32.97 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 121.231 1.287 . . . . 0.0 110.283 172.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.32 -13.71 45.75 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.089 175.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.705 ' HA ' ' OD2' ' A' ' 37' ' ' ASP . . . -72.07 -15.17 62.01 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 122.18 0.991 . . . . 0.0 109.478 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.9 mt -85.36 7.34 22.79 Favored 'General case' 0 N--CA 1.426 -1.629 0 CA-C-N 113.592 -1.64 . . . . 0.0 109.403 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -132.89 0.44 3.5 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 118.984 -1.087 . . . . 0.0 109.914 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.705 ' OD2' ' HA ' ' A' ' 34' ' ' ALA . 48.5 m-20 -72.88 176.86 5.28 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.157 -175.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.611 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -65.35 -21.81 66.74 Favored 'General case' 0 C--O 1.203 -1.342 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 170.637 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.62 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 41.0 ttp180 -65.04 -29.52 70.43 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.19 175.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.593 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.02 -39.57 82.31 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-O 118.763 -0.636 . . . . 0.0 110.209 -179.503 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.8 pt-20 -62.81 -28.37 69.96 Favored 'General case' 0 C--O 1.205 -1.257 0 O-C-N 123.238 0.336 . . . . 0.0 110.946 -176.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.489 HD21 HD23 ' A' ' 43' ' ' LEU . 4.6 t30 -76.17 -46.18 29.78 Favored 'General case' 0 C--O 1.265 1.911 0 CA-C-O 121.696 0.76 . . . . 0.0 110.008 177.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 18.3 mt -63.81 -49.57 72.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.204 -178.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.593 HG22 ' O ' ' A' ' 40' ' ' MET . 34.0 m -68.52 -33.17 58.57 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.294 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.383 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -55.21 -46.97 75.92 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 118.325 0.511 . . . . 0.0 109.991 175.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 6.6 t80 -63.1 -48.64 77.7 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.645 174.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.35 -43.52 88.35 Favored 'General case' 0 C--O 1.201 -1.474 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.356 -176.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -66.19 -40.77 90.65 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 124.117 0.967 . . . . 0.0 111.827 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 53.2 pttt -66.71 -40.71 88.55 Favored 'General case' 0 C--O 1.251 1.151 0 CA-C-O 121.497 0.665 . . . . 0.0 109.945 -178.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 79.3 t -71.63 -49.23 47.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.605 179.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.3 tm-20 -57.93 -47.67 82.18 Favored 'General case' 0 CA--C 1.51 -0.594 0 C-N-CA 123.836 0.854 . . . . 0.0 109.17 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.77 -38.72 92.61 Favored Glycine 0 N--CA 1.428 -1.859 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.445 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -64.11 -51.78 62.34 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 111.543 0.201 . . . . 0.0 111.543 178.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.409 ' HE1' ' HB3' ' A' ' 54' ' ' MET . 0.4 OUTLIER -64.28 -32.38 73.96 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 178.025 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.464 ' HH ' ' HB2' ' A' ' 7' ' ' HIS . 71.5 t80 -64.78 -41.62 95.7 Favored 'General case' 0 C--O 1.201 -1.476 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -80.73 -16.78 53.0 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.622 -0.674 . . . . 0.0 112.097 177.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.3 t -82.78 -52.99 6.25 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 122.536 0.334 . . . . 0.0 111.433 -178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.17 161.66 13.18 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -175.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -104.73 6.28 34.04 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.316 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.0 p -162.42 156.22 20.93 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 174.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -67.76 -31.15 70.84 Favored 'General case' 0 C--O 1.201 -1.499 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.458 -178.787 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -65.21 -47.22 77.64 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.303 177.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -58.26 -45.16 88.34 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 111.417 0.155 . . . . 0.0 111.417 175.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -44.14 92.21 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.513 -178.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -62.46 -45.59 92.35 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.295 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.471 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 34.0 m170 -61.1 -53.97 50.47 Favored 'General case' 0 C--O 1.215 -0.741 0 O-C-N 123.274 0.359 . . . . 0.0 111.634 -178.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.4 pp -64.33 -36.73 85.09 Favored 'General case' 0 C--O 1.256 1.417 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -175.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.561 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -74.67 -33.86 62.57 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.475 ' HB2' ' HA ' ' B' ' 149' ' ' LEU . . . -63.46 -32.76 74.3 Favored 'General case' 0 C--O 1.205 -1.275 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.343 175.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 22.1 mt-10 -72.4 -41.37 66.36 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.276 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.561 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -65.82 -39.03 90.45 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.403 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.448 HG13 ' CB ' ' A' ' 25' ' ' ALA . 8.7 tt -68.24 -42.99 85.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.297 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.476 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 39.1 t80 -58.19 -52.48 65.38 Favored 'General case' 0 C--O 1.259 1.578 0 C-N-CA 124.427 1.091 . . . . 0.0 111.348 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.0 ptpt -64.4 -33.34 75.63 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.414 HD12 ' O ' ' A' ' 71' ' ' LYS . 1.4 mp -68.92 -37.68 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.867 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.167 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.497 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 11.5 mt-30 -66.6 -41.48 88.38 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.629 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 10.6 ptpt -75.23 -27.09 59.37 Favored 'General case' 0 N--CA 1.424 -1.763 0 C-N-CA 118.982 -1.087 . . . . 0.0 112.759 176.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.509 ' OE2' ' HG2' ' A' ' 82' ' ' LYS . 5.5 tm-20 -62.56 -48.89 77.51 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 175.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 83' ' ' ARG . 4.6 pp -63.7 -39.67 94.89 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.836 178.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -55.56 -53.6 54.4 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 123.466 0.479 . . . . 0.0 111.289 176.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -68.92 -47.03 66.78 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 120.15 -0.62 . . . . 0.0 112.418 -177.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.509 ' HG2' ' OE2' ' A' ' 78' ' ' GLU 0.254 0.0 OUTLIER -74.09 -38.73 63.79 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -176.337 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 7.6 mmm180 -78.03 -26.08 48.23 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.9 tpt180 -98.74 -58.38 1.96 Allowed 'General case' 0 N--CA 1.427 -1.617 0 C-N-CA 117.689 -1.604 . . . . 0.0 112.153 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.5 m -161.75 96.26 1.02 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -173.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.504 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 4.9 ptt180 -158.58 -34.48 0.07 Allowed 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 120.971 0.415 . . . . 0.0 110.274 168.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 C--O 1.242 0.71 0 O-C-N 122.28 -0.262 . . . . 0.0 110.627 -176.778 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . 0.455 ' C ' ' H ' ' B' ' 103' ' ' MET . . . . . . . . 0 CA--C 1.493 -1.296 0 N-CA-C 111.209 -0.757 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 8.9 m -81.02 24.74 0.49 Allowed 'General case' 0 C--N 1.308 -1.201 0 CA-C-O 121.372 0.606 . . . . 0.0 110.104 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' MET . . . . . 0.455 ' H ' ' C ' ' B' ' 101' ' ' GLY . 82.9 mtp -78.48 -30.6 47.42 Favored 'General case' 0 CA--C 1.506 -0.712 0 C-N-CA 123.587 0.755 . . . . 0.0 110.634 -176.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 23.1 t -147.66 -59.26 0.26 Allowed 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -178.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -75.32 106.02 6.63 Favored 'General case' 0 C--O 1.215 -0.741 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 176.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -97.19 1.23 49.54 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.628 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -108.02 -64.42 0.58 Allowed Glycine 0 N--CA 1.432 -1.607 0 N-CA-C 109.384 -1.486 . . . . 0.0 109.384 174.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -93.74 52.64 1.71 Allowed 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.66 0.743 . . . . 0.0 109.343 178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -59.65 -27.89 66.75 Favored 'General case' 0 C--O 1.249 1.031 0 CA-C-N 114.666 -1.152 . . . . 0.0 112.215 -178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 14.6 t -66.78 -25.25 66.38 Favored 'General case' 0 N--CA 1.421 -1.906 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.221 -179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 43.3 tp -56.99 -59.78 4.55 Favored 'General case' 0 C--O 1.261 1.684 0 CA-C-N 118.192 0.451 . . . . 0.0 110.51 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.41 HE22 ' HB2' ' B' ' 103' ' ' MET . 20.4 pt20 -75.65 -35.51 60.41 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.895 -176.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . 0.454 ' HB2' ' CA ' ' B' ' 101' ' ' GLY . 22.7 t70 -67.98 -45.44 74.15 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.231 0.539 . . . . 0.0 110.845 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.412 HD21 ' HB3' ' A' ' 79' ' ' LEU . 52.9 tp -69.52 -32.04 70.64 Favored 'General case' 0 C--O 1.201 -1.454 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.038 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.2 tp -67.83 -36.71 80.83 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.192 177.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 88.0 m -64.92 -46.73 80.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.097 176.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.5 m -64.12 -38.08 89.76 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.616 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -62.34 -46.86 86.78 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 123.746 0.818 . . . . 0.0 111.851 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 15.9 t -61.05 -22.7 64.83 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.273 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 8.3 tt -65.32 -44.25 88.42 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 45.4 m -77.16 -45.9 25.2 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.271 176.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 46.9 t60 71.89 -39.2 0.44 Allowed 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 126.268 1.827 . . . . 0.0 113.8 177.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 9.5 p -81.49 -171.94 3.56 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -88.21 176.66 7.15 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -177.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -89.46 118.38 5.2 Favored Glycine 0 N--CA 1.441 -0.992 0 N-CA-C 114.562 0.585 . . . . 0.0 114.562 -172.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -142.12 115.33 0.96 Allowed Glycine 0 C--N 1.294 -1.773 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 175.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -167.42 -163.85 22.04 Favored Glycine 0 N--CA 1.442 -0.963 0 C-N-CA 120.208 -0.996 . . . . 0.0 111.99 -178.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 16.8 m -78.9 -178.08 5.86 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 123.975 0.91 . . . . 0.0 110.597 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -162.64 -49.96 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 119.729 -1.224 . . . . 0.0 113.935 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -85.74 -147.09 9.53 Favored Glycine 0 C--O 1.241 0.588 0 C-N-CA 121.425 -0.417 . . . . 0.0 113.299 -176.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 104.48 158.43 23.84 Favored Glycine 0 N--CA 1.441 -0.984 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 32.2 p -148.33 -175.27 4.85 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 117.027 0.414 . . . . 0.0 109.949 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -138.14 -146.88 5.11 Favored Glycine 0 C--N 1.309 -0.951 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 177.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -162.19 -1.67 0.06 OUTLIER Glycine 0 C--N 1.31 -0.899 0 C-N-CA 119.557 -1.306 . . . . 0.0 113.848 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -80.86 -57.69 2.81 Favored Glycine 0 N--CA 1.436 -1.36 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.959 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 58.6 p -120.74 -97.05 0.46 Allowed 'General case' 0 CA--C 1.557 1.229 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 -173.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 24.7 mt -86.5 -29.34 22.81 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 122.905 1.336 . . . . 0.0 108.621 -175.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.552 ' HA ' ' SD ' ' B' ' 141' ' ' MET . 7.8 pt-20 -57.66 -13.52 4.11 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 128.975 2.91 . . . . 0.0 116.221 -173.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 54.2 m -51.59 -57.03 10.27 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 118.474 0.579 . . . . 0.0 112.47 -174.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -149.12 77.17 1.35 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 123.176 1.465 . . . . 0.0 108.899 175.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.552 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 24.9 ptt? -104.35 -16.99 14.97 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 113.857 -1.519 . . . . 0.0 113.089 -176.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -28.51 -61.14 0.12 Allowed 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 126.543 1.937 . . . . 0.0 116.162 -172.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 18.5 m -68.04 -35.72 78.72 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.105 0.478 . . . . 0.0 111.48 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 62.1 mt -72.16 -45.79 60.9 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.891 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.6 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 18.0 tt -68.26 -31.57 52.09 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.4 -178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 49.3 ttp180 -64.86 -54.75 26.07 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 33.1 t -59.24 -50.15 75.11 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.787 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -81.27 -42.69 20.28 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -175.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.6 ' HB3' ' O ' ' B' ' 145' ' ' ILE . 4.0 tt -80.6 -25.55 38.4 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -172.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . 0.28 0.0 OUTLIER -150.16 177.58 9.78 Favored 'General case' 0 N--CA 1.437 -1.122 0 C-N-CA 118.131 -1.428 . . . . 0.0 113.485 177.329 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -103.57 114.69 29.15 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -173.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.522 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 -179.882 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.38 0 N-CA-C 112.165 -0.374 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.1 t -74.71 117.45 18.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.488 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.91 101.01 13.72 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 14.6 ptpt -109.78 93.74 4.66 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.669 -175.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.2 -12.26 16.02 Favored Glycine 0 N--CA 1.465 0.612 0 N-CA-C 116.075 1.19 . . . . 0.0 116.075 -173.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.462 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 57.3 p-90 -64.06 -17.07 63.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.542 0.671 . . . . 0.0 111.035 178.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -63.33 -10.39 16.2 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.7 -30.45 59.32 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.349 0.595 . . . . 0.0 109.88 175.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -93.11 20.41 6.87 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.524 -174.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.411 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.7 p -132.98 110.19 15.1 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -75.89 153.07 36.98 Favored 'General case' 0 C--N 1.294 -1.839 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.916 -173.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -38.84 86.1 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 174.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.523 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 3.5 m-20 -56.91 -39.14 73.89 Favored 'General case' 0 C--O 1.214 -0.763 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.629 174.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.56 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.3 tm? -72.42 -52.35 16.33 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -173.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.507 ' O ' HG22 ' A' ' 19' ' ' VAL . 5.6 ptm180 -66.15 -43.37 87.21 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-N 114.944 -1.025 . . . . 0.0 113.293 -176.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.2 t -67.11 -28.66 68.34 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.523 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 14.9 t60 -65.71 -44.12 87.04 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 176.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.56 HD12 ' O ' ' A' ' 14' ' ' LEU . 4.1 mp -65.26 -41.41 94.27 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.888 176.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 15' ' ' ARG . 67.6 t -57.21 -52.42 56.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.665 0.786 . . . . 0.0 110.169 176.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.421 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 20.5 t-80 -54.93 -43.79 73.65 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.494 177.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.433 ' HD3' ' HG ' ' B' ' 149' ' ' LEU . 36.2 mttp -66.1 -37.95 87.02 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.375 177.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.2 mt -55.67 -43.08 75.99 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 175.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.452 HG13 ' HE3' ' A' ' 40' ' ' MET . 53.6 t -57.25 -52.65 53.84 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.628 0 O-C-N 124.155 0.91 . . . . 0.0 110.411 173.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -59.05 -29.15 67.09 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.71 -45.31 15.88 Favored 'General case' 0 C--O 1.207 -1.133 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.769 174.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.44 HG23 ' HA ' ' A' ' 23' ' ' VAL . 2.7 tt -69.78 -33.75 57.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-O 122.07 0.938 . . . . 0.0 110.233 -177.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -126.39 92.26 45.77 Favored Pre-proline 0 N--CA 1.4 -2.971 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -57.7 102.17 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 121.849 1.7 . . . . 0.0 107.955 171.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 t -73.92 128.27 86.88 Favored Pre-proline 0 N--CA 1.408 -2.568 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.637 -172.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -72.65 -28.83 13.66 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.417 2.078 . . . . 0.0 111.438 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -151.01 147.12 20.04 Favored Pre-proline 0 CA--C 1.498 -1.033 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -177.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -56.93 -19.66 33.03 Favored 'Trans proline' 0 CA--C 1.549 1.274 0 C-N-CA 122.359 2.039 . . . . 0.0 114.171 175.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.38 -19.97 59.24 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 121.406 -0.809 . . . . 0.0 112.005 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.68 -7.56 50.99 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.383 0.611 . . . . 0.0 110.421 178.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.494 ' O ' ' HG2' ' A' ' 40' ' ' MET . 23.6 mt -93.48 0.31 56.68 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.689 -178.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -133.72 19.77 3.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.243 0.544 . . . . 0.0 111.979 -177.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.541 ' O ' ' HB3' ' A' ' 40' ' ' MET . 38.0 t70 -92.12 176.69 6.4 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.78 ' HD2' ' N ' ' A' ' 39' ' ' ARG . 5.4 ppt_? -61.54 -26.1 67.72 Favored 'General case' 0 C--N 1.282 -2.358 0 CA-C-O 121.922 0.868 . . . . 0.0 108.934 172.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.78 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 40.6 ttm180 -63.52 -29.41 70.68 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-O 122.145 0.974 . . . . 0.0 109.109 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.715 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.7 tpp -65.13 -34.64 78.89 Favored 'General case' 0 C--O 1.192 -1.95 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.312 -178.355 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.1 pt-20 -63.64 -32.89 74.51 Favored 'General case' 0 C--O 1.189 -2.081 0 C-N-CA 119.396 -0.922 . . . . 0.0 109.445 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -68.99 -49.85 54.21 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 121.589 0.709 . . . . 0.0 110.045 176.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 67.2 mt -63.7 -48.07 78.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.6 -176.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.715 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.4 p -73.42 -27.88 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.885 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.209 -178.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -60.8 -45.56 93.94 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 177.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.495 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.1 t80 -60.73 -46.36 90.74 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.942 174.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.23 -40.17 93.01 Favored 'General case' 0 C--O 1.202 -1.443 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.956 -177.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 65.0 mttm -68.38 -43.72 76.73 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 123.312 0.645 . . . . 0.0 111.306 178.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.3 pttp -65.74 -38.18 88.42 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 121.118 0.485 . . . . 0.0 109.918 -177.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 41.3 t -70.76 -49.66 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.268 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.401 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -56.04 -44.67 79.0 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.49 -37.97 95.6 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.62 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -59.42 -54.25 48.81 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -34.22 76.5 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.93 -49.85 75.79 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -77.33 -17.68 58.08 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 28.3 t -87.42 -30.85 20.4 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 120.825 0.345 . . . . 0.0 110.929 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.29 159.51 23.13 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 121.246 0.546 . . . . 0.0 111.633 -177.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -108.59 8.48 27.15 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-O 121.717 0.77 . . . . 0.0 110.4 -177.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 83.1 p -160.71 160.71 31.78 Favored 'General case' 0 N--CA 1.417 -2.101 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 173.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.411 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.3 -26.76 62.08 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.047 176.677 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -65.48 -47.82 74.77 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -62.83 -46.22 88.94 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.163 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -48.09 76.09 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.845 -176.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -61.38 -45.36 94.67 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 123.796 0.685 . . . . 0.0 110.304 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.472 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 10.7 t60 -67.95 -49.86 59.3 Favored 'General case' 0 C--O 1.203 -1.372 0 CA-C-O 119.23 -0.414 . . . . 0.0 111.752 -176.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.1 pp -64.55 -35.37 80.76 Favored 'General case' 0 C--O 1.271 2.219 0 CA-C-N 118.517 0.599 . . . . 0.0 111.662 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.486 HD22 HD21 ' A' ' 18' ' ' LEU . 1.3 pp -70.1 -38.55 75.67 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.458 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -64.75 -35.74 82.06 Favored 'General case' 0 C--O 1.2 -1.508 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.561 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 16.0 mt-10 -67.76 -43.78 79.04 Favored 'General case' 0 C--N 1.312 -1.039 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.684 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -38.93 74.76 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 118.663 -1.215 . . . . 0.0 111.732 -179.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.458 HG23 ' HA ' ' A' ' 69' ' ' ALA . 9.6 tt -65.62 -40.41 87.92 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 C-N-CA 120.564 -0.455 . . . . 0.0 110.112 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.481 ' CZ ' ' HE3' ' A' ' 77' ' ' LYS . 36.6 t80 -57.31 -54.5 46.15 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 124.682 1.193 . . . . 0.0 111.121 179.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.5 ptpt -66.44 -32.34 73.64 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.083 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.78 -36.92 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.809 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.154 177.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.554 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 19.6 mt-30 -67.44 -47.75 69.26 Favored 'General case' 0 CA--C 1.498 -1.056 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.635 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.582 ' HB3' ' HZ3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -69.45 -28.12 65.83 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.404 -0.919 . . . . 0.0 112.627 177.505 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.6 tp10 -65.16 -47.85 75.59 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -65.41 -36.07 82.82 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.533 -178.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.98 -47.29 78.08 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.351 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.37 -33.37 65.01 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 119.49 -0.884 . . . . 0.0 111.773 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -64.58 -36.17 83.37 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.794 178.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 16.2 tpp180 -77.66 -36.47 51.38 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.227 178.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 8.5 tpp180 -87.54 -59.68 2.18 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 119.648 -0.821 . . . . 0.0 112.955 -175.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.9 p -178.95 81.99 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -110.22 -25.61 10.06 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 171.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.7 mt . . . . . 0 C--O 1.245 0.834 0 CA-C-N 114.227 -1.352 . . . . 0.0 109.061 175.947 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.232 0 N-CA-C 111.435 -0.666 . . . . 0.0 111.435 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 16.7 m -77.71 109.7 11.92 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 49.4 tpp -132.53 -31.78 1.36 Allowed 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.588 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 14.1 t 49.79 44.86 25.05 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 124.152 0.981 . . . . 0.0 111.389 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 60.0 t60 -127.43 -26.82 2.98 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -174.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 67.23 -164.75 0.22 Allowed 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -172.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.41 -58.64 4.86 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 -176.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -118.24 34.58 5.11 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 123.753 0.821 . . . . 0.0 110.235 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.33 -27.2 68.88 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.389 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 6.9 m -64.02 -39.47 94.17 Favored 'General case' 0 N--CA 1.421 -1.917 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.683 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 60.9 tp -68.41 -33.43 74.21 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.32 -0.4 . . . . 0.0 109.956 178.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -64.71 -53.02 53.91 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.444 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -60.8 -39.3 88.39 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.181 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.42 HD22 ' HB3' ' A' ' 79' ' ' LEU . 62.4 tp -62.71 -44.62 95.77 Favored 'General case' 0 C--O 1.203 -1.389 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.618 177.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 60.8 tp -63.57 -38.82 92.57 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 26.4 m -65.19 -40.15 93.84 Favored 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.983 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.3 t -77.53 -25.58 50.34 Favored 'General case' 0 CA--C 1.561 1.389 0 CA-C-O 121.28 0.562 . . . . 0.0 110.204 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -69.09 -37.75 78.59 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 121.951 0.882 . . . . 0.0 109.163 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 19.1 p -76.25 -11.32 59.89 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.257 175.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 3.9 tt -85.08 -29.9 24.51 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 43.0 m -67.5 -38.32 84.14 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.58 175.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 62.5 m80 72.98 -45.37 0.62 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 125.163 1.385 . . . . 0.0 112.641 178.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 24.6 m -122.77 139.2 54.25 Favored 'General case' 0 N--CA 1.421 -1.91 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -76.51 151.57 36.36 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -145.9 -84.32 0.06 OUTLIER Glycine 0 C--N 1.298 -1.536 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 170.42 162.58 23.0 Favored Glycine 0 N--CA 1.427 -1.947 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.408 176.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -113.38 38.11 3.34 Favored Glycine 0 N--CA 1.432 -1.61 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 177.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 2.3 p -80.28 132.68 35.87 Favored 'General case' 0 N--CA 1.425 -1.694 0 C-N-CA 123.671 0.789 . . . . 0.0 111.394 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 176.33 154.23 11.46 Favored Glycine 0 N--CA 1.424 -2.138 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 167.72 -158.07 30.72 Favored Glycine 0 C--N 1.298 -1.554 0 N-CA-C 109.225 -1.55 . . . . 0.0 109.225 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 126.65 32.23 0.72 Allowed Glycine 0 C--N 1.308 -0.977 0 C-N-CA 119.272 -1.442 . . . . 0.0 113.859 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 48.4 t 62.05 -157.74 0.33 Allowed 'General case' 0 CA--C 1.561 1.374 0 CA-C-N 116.947 0.374 . . . . 0.0 110.713 176.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -175.66 -62.75 0.06 OUTLIER Glycine 0 N--CA 1.433 -1.506 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . 0.429 ' H ' ' HG2' ' B' ' 138' ' ' GLU . . . 94.14 121.68 3.42 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.926 -0.654 . . . . 0.0 111.785 -178.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 151.78 -49.72 0.53 Allowed Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.529 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 23.2 t -159.87 -78.55 0.06 Allowed 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 116.885 0.343 . . . . 0.0 111.711 -178.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 70.5 mt -97.17 -30.38 13.04 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-O 121.811 0.815 . . . . 0.0 111.132 -173.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.518 ' HA ' ' SD ' ' B' ' 141' ' ' MET . 0.0 OUTLIER -77.75 -13.19 59.97 Favored 'General case' 0 C--N 1.291 -1.96 0 C-N-CA 124.866 1.267 . . . . 0.0 112.97 -172.901 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 34.6 t -49.28 -59.41 3.71 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.56 0.744 . . . . 0.0 111.233 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -140.4 73.05 1.41 Allowed 'General case' 0 CA--C 1.494 -1.179 0 CA-C-O 122.093 0.949 . . . . 0.0 109.025 174.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.518 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 26.8 ptt? -102.92 -18.67 14.95 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.633 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -22.02 -65.42 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 126.876 2.071 . . . . 0.0 116.218 -174.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.4 p -69.84 -43.92 70.97 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.256 0.551 . . . . 0.0 112.01 -176.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 45.8 mm -69.57 -40.54 79.7 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.465 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 13.2 tt -67.42 -36.78 77.47 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.863 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -55.03 -51.64 65.65 Favored 'General case' 0 C--O 1.25 1.11 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.3 m -61.48 -52.36 64.83 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-N 114.509 -1.223 . . . . 0.0 112.567 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -68.52 -47.83 65.94 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.438 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 2.5 tm? -76.03 -40.79 52.68 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 114.953 -1.021 . . . . 0.0 112.756 -168.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . 0.299 3.7 ppp? -150.23 -48.55 0.13 Allowed 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 117.86 2.541 . . . . 0.0 117.86 -175.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 27.5 t70 46.1 88.54 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 124.453 1.101 . . . . 0.0 113.034 -178.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.303 0 CA-C-O 118.528 -0.749 . . . . 0.0 109.168 179.996 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.481 -2.04 0 N-CA-C 110.734 -0.947 . . . . 0.0 110.734 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 82.1 t -111.07 119.43 59.61 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.104 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.46 109.43 3.69 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.844 0.83 . . . . 0.0 109.585 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.609 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.3 ptpt -130.63 105.38 7.78 Favored 'General case' 0 C--N 1.28 -2.419 0 CA-C-N 114.603 -1.18 . . . . 0.0 112.048 -176.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.15 -9.65 84.1 Favored Glycine 0 C--O 1.24 0.517 0 CA-C-N 115.076 -0.965 . . . . 0.0 113.273 -175.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.609 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 65.0 p-90 -68.73 -7.59 35.07 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -59.83 -26.17 65.57 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 120.977 0.418 . . . . 0.0 111.703 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -86.81 0.33 55.04 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.547 0.689 . . . . 0.0 110.677 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 -104.95 3.01 30.28 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.953 -178.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.571 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 1.5 t -119.28 128.51 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.681 0 N-CA-C 103.968 -2.604 . . . . 0.0 103.968 176.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.481 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -77.66 151.46 34.26 Favored 'General case' 0 C--N 1.275 -2.665 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -36.15 79.35 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 174.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 32.8 t70 -72.66 -27.83 62.35 Favored 'General case' 0 C--O 1.199 -1.581 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.619 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 17' ' ' HIS . 3.2 tm? -70.03 -52.95 19.92 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -177.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.5 ' O ' HG22 ' A' ' 19' ' ' VAL . 1.1 ptm180 -57.89 -48.67 79.16 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 175.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.4 m -67.89 -21.19 65.16 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.192 0.52 . . . . 0.0 111.816 -177.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.435 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 15.9 t60 -69.63 -47.24 64.11 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 175.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.49 HD22 HD23 ' A' ' 68' ' ' LEU . 1.2 mp -64.83 -40.52 95.31 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.768 177.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 15' ' ' ARG . 78.8 t -56.69 -50.38 74.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.68 0.792 . . . . 0.0 109.939 174.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 27.0 t-80 -54.86 -44.15 73.74 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.861 0.864 . . . . 0.0 109.907 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.425 ' HZ2' ' CD1' ' B' ' 145' ' ' ILE . 76.7 mttt -69.48 -36.63 76.72 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.924 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.423 ' O ' HG22 ' A' ' 26' ' ' ILE . 63.7 mt -56.38 -45.28 80.64 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 175.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.443 HG11 ' HE1' ' A' ' 40' ' ' MET . 42.1 t -54.88 -55.56 15.26 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.41 0 O-C-N 124.211 0.944 . . . . 0.0 109.907 172.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -56.63 -30.1 62.93 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -176.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.436 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -81.32 -45.14 16.62 Favored 'General case' 0 C--O 1.208 -1.081 0 O-C-N 122.18 -0.325 . . . . 0.0 111.717 175.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.423 HG22 ' O ' ' A' ' 22' ' ' LEU . 2.8 tt -70.82 -34.92 58.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 122.051 0.929 . . . . 0.0 110.304 -179.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.455 ' CD2' HD22 ' A' ' 43' ' ' LEU . 11.0 m-85 -136.99 88.01 18.35 Favored Pre-proline 0 C--N 1.267 -3.003 0 C-N-CA 124.357 1.063 . . . . 0.0 109.751 -177.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -44.76 133.03 10.47 Favored 'Trans proline' 0 CA--C 1.487 -1.864 0 C-N-CA 122.696 2.264 . . . . 0.0 112.431 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 m -90.27 117.92 68.41 Favored Pre-proline 1 N--CA 1.364 -4.737 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.746 -173.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.456 ' HA ' ' O ' ' B' ' 124' ' ' ASP . 55.2 Cg_endo -76.29 -32.38 4.04 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.702 2.268 . . . . 0.0 111.745 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -153.59 144.17 15.83 Favored Pre-proline 0 CA--C 1.489 -1.372 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 -177.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.411 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 9.4 Cg_endo -56.02 -23.25 42.71 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.68 2.253 . . . . 0.0 113.817 176.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.26 -14.18 60.88 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 121.377 -0.827 . . . . 0.0 111.719 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.29 -15.55 61.9 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.697 0.761 . . . . 0.0 109.487 176.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.497 ' O ' ' HG2' ' A' ' 40' ' ' MET . 10.4 mt -88.32 -0.87 57.63 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.043 -176.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.479 ' HB3' ' HZ1' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -133.39 16.82 4.04 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.648 0.737 . . . . 0.0 109.29 176.704 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.582 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 17.0 t70 -86.36 173.55 9.62 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.109 -176.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.582 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.67 -25.68 62.21 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.025 0.44 . . . . 0.0 110.651 174.262 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.576 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 6.4 tpt180 -62.84 -38.09 89.4 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 175.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.829 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.3 tpp -56.16 -37.18 69.19 Favored 'General case' 0 C--O 1.192 -1.932 0 CA-C-N 113.574 -1.648 . . . . 0.0 112.691 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -61.79 -32.73 73.04 Favored 'General case' 0 C--O 1.212 -0.887 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.652 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -77.21 -43.5 33.43 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-O 121.406 0.622 . . . . 0.0 110.0 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 20.5 mt -63.72 -45.71 88.7 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.644 -178.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.829 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.0 p -73.34 -28.58 25.84 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.368 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.13 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.24 -44.23 95.43 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 176.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.512 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.5 t80 -62.51 -45.8 91.33 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.888 173.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.72 91.55 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.943 -177.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -68.25 -41.05 81.71 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 123.608 0.763 . . . . 0.0 112.375 178.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.512 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 58.3 pttt -65.84 -40.3 91.6 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 55.5 t -71.06 -48.33 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.884 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -58.25 -45.72 87.28 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.85 -42.42 96.6 Favored Glycine 0 N--CA 1.433 -1.522 0 O-C-N 123.928 0.768 . . . . 0.0 112.744 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -58.18 -54.7 44.03 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.452 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.6 OUTLIER -67.0 -33.9 76.56 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.502 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -63.62 -45.17 91.52 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -79.05 -16.59 56.59 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 121.888 -0.507 . . . . 0.0 111.727 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.452 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 29.9 m -87.1 -27.81 22.89 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.63 167.39 15.38 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.52 0.676 . . . . 0.0 112.576 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -115.31 8.63 15.47 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.532 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.4 p -166.66 150.27 7.05 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 175.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.571 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -60.82 -34.15 74.1 Favored 'General case' 0 C--O 1.199 -1.598 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.3 175.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.78 -47.91 83.79 Favored 'General case' 0 C--O 1.219 -0.542 0 O-C-N 123.857 0.723 . . . . 0.0 109.571 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -62.96 -47.34 83.61 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.715 177.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -46.39 82.94 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.875 -176.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.414 ' HH ' HG22 ' B' ' 144' ' ' ILE . 4.7 t80 -60.92 -44.87 96.59 Favored 'General case' 0 C--O 1.208 -1.13 0 O-C-N 123.84 0.713 . . . . 0.0 109.752 177.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -58.43 -57.21 13.95 Favored 'General case' 0 C--N 1.323 -0.543 0 O-C-N 123.606 0.566 . . . . 0.0 111.815 -178.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.7 pp -65.41 -37.11 85.97 Favored 'General case' 0 C--O 1.27 2.156 0 CA-C-O 121.317 0.579 . . . . 0.0 112.167 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.49 HD23 HD22 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -70.7 -36.89 73.48 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 -179.174 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.433 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -62.72 -38.39 90.28 Favored 'General case' 0 C--O 1.209 -1.077 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.232 178.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -61.15 -51.23 69.93 Favored 'General case' 0 C--O 1.262 1.735 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.701 179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.418 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -68.55 -39.38 81.11 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.587 -0.845 . . . . 0.0 112.621 -178.155 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.555 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 6.8 tt -64.49 -44.89 96.96 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.891 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.803 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.484 ' CE1' ' HE2' ' A' ' 77' ' ' LYS . 65.3 t80 -53.4 -52.79 58.19 Favored 'General case' 0 C--O 1.259 1.574 0 C-N-CA 125.227 1.411 . . . . 0.0 111.238 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.456 ' HB3' ' HZ2' ' A' ' 74' ' ' LYS . 0.4 OUTLIER -65.67 -32.26 73.72 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.808 -178.312 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.419 HG23 ' HB2' ' A' ' 25' ' ' ALA . 1.5 mp -70.83 -35.63 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.298 176.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 72' ' ' ILE . 22.7 mm-40 -60.03 -47.58 85.25 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 122.08 0.943 . . . . 0.0 109.703 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.1 OUTLIER -72.79 -28.12 62.4 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.521 -0.872 . . . . 0.0 112.872 178.605 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.413 ' OE2' HD22 ' B' ' 111' ' ' LEU . 0.6 OUTLIER -60.39 -53.43 57.73 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 175.609 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -60.35 -41.59 93.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.941 -177.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.476 ' HB3' ' NH2' ' A' ' 84' ' ' ARG . 12.5 mm-40 -59.1 -53.67 55.7 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.239 176.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.9 pt-20 -71.58 -37.76 70.99 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -174.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -33.36 62.34 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -75.65 -31.64 59.89 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.852 0.834 . . . . 0.0 109.915 178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.476 ' NH2' ' HB3' ' A' ' 80' ' ' GLU . 34.2 ttm180 -75.1 -21.39 58.93 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.702 -1.136 . . . . 0.0 109.237 175.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 54.8 m 86.19 128.88 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 126.482 1.913 . . . . 0.0 113.16 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -133.05 -29.98 1.39 Allowed 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.782 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.7 mp . . . . . 0 N--CA 1.473 0.698 0 O-C-N 122.166 -0.334 . . . . 0.0 110.159 175.344 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.508 -0.383 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 7.6 p -69.83 -21.6 63.36 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 123.398 0.679 . . . . 0.0 112.355 -176.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 96.8 mmm -93.27 3.06 56.28 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.577 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 45.6 t 66.48 -176.11 0.19 Allowed 'General case' 0 CA--C 1.549 0.928 0 O-C-N 123.716 0.635 . . . . 0.0 110.511 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -105.96 -5.41 19.62 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -89.38 176.55 6.88 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.784 177.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.51 -39.19 2.91 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -136.6 23.4 3.15 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -177.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 5.2 pm0 -56.74 -40.69 76.2 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.516 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 22.7 m -73.4 -32.57 64.51 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.391 -176.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . 0.413 HD22 ' OE2' ' A' ' 78' ' ' GLU . 7.8 mt -66.3 -47.93 72.0 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -175.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -71.69 -41.64 68.38 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.647 -177.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.74 -53.26 60.08 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-O 121.883 0.849 . . . . 0.0 109.453 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 50.8 tp -67.51 -27.12 66.72 Favored 'General case' 0 C--O 1.189 -2.115 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.783 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.403 ' HA ' ' HB3' ' B' ' 118' ' ' ASP . 59.0 tp -68.6 -40.01 80.64 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 121.334 0.588 . . . . 0.0 109.685 176.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 36.6 m -60.72 -38.1 83.97 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.14 178.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.4 m -72.27 -50.46 26.98 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-O 121.388 0.613 . . . . 0.0 111.062 174.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.403 ' HB3' ' HA ' ' B' ' 115' ' ' LEU . 3.2 t70 -56.05 -18.61 10.03 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 126.766 2.026 . . . . 0.0 113.941 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 78.6 p -56.78 -19.34 16.52 Favored 'General case' 0 CA--C 1.562 1.415 0 CA-C-O 120.905 0.383 . . . . 0.0 111.654 174.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 39.3 tp -66.95 -47.02 72.91 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.86 0.864 . . . . 0.0 111.434 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 7.3 p -77.12 -40.72 44.7 Favored 'General case' 0 C--O 1.245 0.853 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -174.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 55.2 m-70 72.59 -72.98 0.1 Allowed 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.473 1.109 . . . . 0.0 110.955 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 20.9 t 171.57 85.48 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 104.051 -2.574 . . . . 0.0 104.051 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . 0.456 ' O ' ' HA ' ' A' ' 30' ' ' PRO . 24.4 t70 -175.92 128.71 0.23 Allowed 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -171.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -151.72 101.92 0.22 Allowed Glycine 0 N--CA 1.44 -1.053 0 C-N-CA 120.981 -0.628 . . . . 0.0 111.847 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -92.34 9.31 76.38 Favored Glycine 0 C--N 1.308 -1.025 0 N-CA-C 114.49 0.556 . . . . 0.0 114.49 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 148.41 167.36 13.56 Favored Glycine 0 C--N 1.312 -0.751 0 C-N-CA 119.971 -1.109 . . . . 0.0 112.656 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 28.2 t -164.61 -159.06 0.44 Allowed 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 94.71 -68.45 1.26 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.626 -0.321 . . . . 0.0 112.669 178.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 87.34 -106.24 3.15 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.724 -0.75 . . . . 0.0 111.748 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -160.51 179.11 36.22 Favored Glycine 0 N--CA 1.435 -1.376 0 N-CA-C 111.064 -0.814 . . . . 0.0 111.064 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 20.1 m -154.14 123.3 6.44 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -83.39 -133.16 2.13 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.645 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -174.13 79.25 0.08 OUTLIER Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.39 -0.91 . . . . 0.0 111.735 179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -127.91 -40.69 0.3 Allowed Glycine 0 C--N 1.295 -1.7 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 16.6 p -140.75 -79.48 0.27 Allowed 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 39.4 mt -105.06 -17.3 14.54 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -172.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.435 ' HA ' ' SD ' ' B' ' 141' ' ' MET . 0.0 OUTLIER -82.23 -13.03 57.69 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 -167.418 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 48.5 t -72.15 -60.0 2.45 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 118.742 0.701 . . . . 0.0 110.964 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -109.8 66.16 0.63 Allowed 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 179.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.435 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 25.4 ttt -102.66 -22.74 13.92 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 113.994 -1.457 . . . . 0.0 113.539 -170.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -42.37 -53.36 4.25 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 -169.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.3 p -64.82 -50.43 66.73 Favored 'General case' 0 C--O 1.255 1.375 0 CA-C-O 121.55 0.691 . . . . 0.0 111.115 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.414 HG22 ' HH ' ' A' ' 65' ' ' TYR . 63.2 mt -58.0 -50.77 76.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.78 -177.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.43 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 0.0 OUTLIER -67.01 -40.37 85.41 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.276 -177.252 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' B' ' 150' ' ' MET . 16.5 ttp180 -64.61 -58.5 6.18 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 118.954 -1.098 . . . . 0.0 111.23 -176.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.9 m -66.1 -41.1 91.07 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 -175.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -81.6 -48.05 12.26 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.349 0.499 . . . . 0.0 112.349 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.416 ' O ' ' HB3' ' B' ' 150' ' ' MET . 9.4 tt -95.86 -42.83 8.13 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -170.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.439 ' O ' ' HA ' ' B' ' 146' ' ' ARG . 0.0 OUTLIER -178.16 130.21 0.14 Allowed 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.625 1.102 . . . . 0.0 113.229 -178.909 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -119.57 -58.95 1.87 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 105.156 -2.165 . . . . 0.0 105.156 172.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.446 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 172.699 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.482 -1.988 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.42 ' O ' ' HG3' ' A' ' 4' ' ' LYS . 58.3 t 66.15 104.24 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.044 0.937 . . . . 0.0 109.627 -175.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.6 106.65 6.28 Favored 'General case' 0 C--N 1.278 -2.523 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.032 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.42 ' HG3' ' O ' ' A' ' 2' ' ' VAL . 43.6 mttp -104.98 123.08 47.17 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.184 -0.916 . . . . 0.0 108.891 -177.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.43 -15.47 61.47 Favored Glycine 0 C--N 1.315 -0.639 0 O-C-N 123.428 0.455 . . . . 0.0 113.88 -174.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -72.38 -8.35 54.5 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 122.335 -0.509 . . . . 0.0 112.355 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.414 ' HD2' ' O ' ' A' ' 4' ' ' LYS . 12.5 p80 -62.4 -21.89 65.73 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.315 0.579 . . . . 0.0 110.425 178.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.17 -7.44 57.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.985 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -112.91 18.01 18.48 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.936 -178.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.57 125.48 19.05 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.23 159.24 19.52 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -176.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.01 -38.21 78.71 Favored 'General case' 0 C--O 1.208 -1.096 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 170.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.518 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 6.6 m-20 -65.86 -31.24 72.07 Favored 'General case' 0 C--O 1.202 -1.421 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.559 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -67.55 -51.88 45.44 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 179.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.581 ' O ' HG21 ' A' ' 19' ' ' VAL . 6.0 ptm180 -64.61 -46.78 81.15 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.209 -1.359 . . . . 0.0 112.536 -177.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.6 t -66.45 -23.19 66.24 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-O 121.275 0.56 . . . . 0.0 110.899 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.518 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 9.5 t60 -69.54 -47.35 64.01 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 176.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 14' ' ' LEU . 5.2 mp -65.01 -41.57 95.23 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.323 -1.308 . . . . 0.0 109.898 177.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.581 HG21 ' O ' ' A' ' 15' ' ' ARG . 67.7 t -55.81 -48.67 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 124.115 0.966 . . . . 0.0 110.39 175.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -55.75 -48.82 74.61 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.433 178.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.442 ' HE2' ' O ' ' B' ' 130' ' ' GLY . 37.5 mttm -65.1 -37.31 87.07 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.026 178.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.485 ' O ' HG23 ' A' ' 26' ' ' ILE . 57.2 mt -53.51 -49.33 67.79 Favored 'General case' 0 CA--C 1.502 -0.869 0 O-C-N 123.577 0.548 . . . . 0.0 109.8 175.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.412 HG12 ' HE2' ' A' ' 40' ' ' MET . 58.6 t -54.87 -51.88 48.43 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.147 0 O-C-N 124.328 1.017 . . . . 0.0 110.172 175.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -56.72 -31.94 65.02 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -177.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.559 ' HB2' ' NE2' ' A' ' 76' ' ' GLN . . . -81.14 -45.94 15.65 Favored 'General case' 0 C--O 1.215 -0.757 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 176.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.485 HG23 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -79.9 -27.38 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-O 122.055 0.931 . . . . 0.0 111.013 -173.719 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -133.17 87.37 39.27 Favored Pre-proline 0 C--N 1.285 -2.21 0 C-N-CA 124.516 1.126 . . . . 0.0 108.997 177.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -58.37 116.1 3.01 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.164 1.909 . . . . 0.0 110.48 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.2 t -88.93 132.41 38.27 Favored Pre-proline 0 N--CA 1.424 -1.741 0 CA-C-O 121.104 0.478 . . . . 0.0 111.308 -174.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.63 -28.7 13.86 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.595 2.197 . . . . 0.0 111.331 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -148.98 155.61 40.48 Favored Pre-proline 0 C--N 1.31 -1.117 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.483 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.451 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 57.1 Cg_endo -73.52 -7.44 20.29 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.005 1.803 . . . . 0.0 114.367 179.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.59 -20.62 26.15 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 121.519 -0.738 . . . . 0.0 110.049 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.77 -12.31 58.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.863 0.839 . . . . 0.0 110.031 174.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.478 ' O ' ' HG2' ' A' ' 40' ' ' MET . 27.6 mt -89.53 2.14 54.99 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.029 -179.253 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.454 ' HZ2' ' HB3' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -132.89 9.93 4.22 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.742 0.782 . . . . 0.0 109.432 175.937 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.628 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 15.7 t70 -86.78 174.28 8.9 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 124.888 1.275 . . . . 0.0 111.004 -175.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.628 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -64.69 -29.19 70.18 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 123.266 0.626 . . . . 0.0 111.17 179.454 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.531 ' O ' HD13 ' A' ' 43' ' ' LEU . 41.2 ttm180 -66.38 -37.24 84.81 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 177.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.797 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 7.5 tpp -58.06 -35.56 71.53 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.716 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.2 pt-20 -61.64 -30.98 71.07 Favored 'General case' 0 C--O 1.209 -1.077 0 C-N-CA 118.63 -1.228 . . . . 0.0 109.369 -178.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -74.8 -46.44 36.82 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.461 177.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.531 HD13 ' O ' ' A' ' 39' ' ' ARG . 1.2 mp -55.1 -58.39 7.87 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.342 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.797 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.8 p -69.59 -29.27 40.82 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.346 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.744 -176.155 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -59.3 -47.45 85.35 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.521 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.3 t80 -59.93 -44.83 94.11 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 174.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.42 -42.29 99.34 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.055 -177.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 64.3 mttm -65.3 -44.11 88.97 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 123.2 0.6 . . . . 0.0 111.002 178.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.521 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 53.7 pttt -65.25 -40.71 94.37 Favored 'General case' 0 C--O 1.246 0.877 0 CA-C-O 121.284 0.564 . . . . 0.0 110.623 -178.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.444 HG23 ' CE2' ' A' ' 46' ' ' TYR . 43.0 t -70.95 -44.21 75.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.953 178.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -56.89 -46.66 81.73 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.09 -34.29 88.54 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.202 177.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.21 -53.8 52.34 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.005 0.431 . . . . 0.0 110.326 178.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -31.07 68.19 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -59.47 -48.82 80.18 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -76.78 -24.9 52.88 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.516 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.8 t -80.33 -11.23 59.73 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -107.53 165.63 11.27 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.975 0.416 . . . . 0.0 111.503 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -112.39 14.21 20.34 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.376 0.607 . . . . 0.0 111.529 177.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 99.6 p -162.26 153.53 17.99 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 171.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.417 ' HD3' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -58.59 -41.18 85.19 Favored 'General case' 0 C--O 1.192 -1.932 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.978 174.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -65.35 -39.92 92.98 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.435 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -63.53 -50.43 69.6 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.145 175.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -44.24 96.75 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.827 -177.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.48 -46.82 88.71 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 124.166 0.916 . . . . 0.0 110.44 177.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.518 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 24.2 t60 -63.38 -50.96 67.83 Favored 'General case' 0 C--O 1.202 -1.419 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.4 pp -64.68 -37.66 88.33 Favored 'General case' 0 C--O 1.276 2.493 0 CA-C-O 121.514 0.674 . . . . 0.0 111.877 -176.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.48 HD23 HD23 ' A' ' 18' ' ' LEU . 1.5 pp -69.59 -35.5 75.38 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 178.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.43 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.83 -35.5 80.83 Favored 'General case' 0 C--O 1.204 -1.298 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.747 177.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.518 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 26.6 mt-10 -66.23 -47.37 74.02 Favored 'General case' 0 C--O 1.252 1.233 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.861 -179.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -40.47 87.96 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 118.578 -1.249 . . . . 0.0 110.599 -178.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.43 HG22 ' HA ' ' A' ' 69' ' ' ALA . 4.4 tt -65.74 -44.13 93.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.117 -178.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.439 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 53.9 t80 -56.39 -53.11 61.25 Favored 'General case' 0 C--O 1.273 2.304 0 C-N-CA 125.36 1.464 . . . . 0.0 110.947 -178.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.5 ptpt -63.48 -39.55 94.74 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.661 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.401 HG23 ' HB3' ' A' ' 25' ' ' ALA . 1.4 mp -61.89 -39.21 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 123.343 0.402 . . . . 0.0 111.514 178.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.692 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 28.7 mm-40 -60.1 -53.48 57.28 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 6.7 ptpt -73.6 -28.78 62.0 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.459 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 8.1 tp10 -59.29 -47.94 83.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 175.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.1 pp -67.27 -37.42 83.42 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.188 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.492 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 4.7 mm-40 -61.12 -53.19 60.1 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.0 pt-20 -73.36 -32.96 64.82 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.451 ' HE2' ' HG3' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -66.07 -31.03 71.67 Favored 'General case' 0 C--N 1.352 0.674 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.095 179.081 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 51.3 mtm180 -78.11 -39.47 41.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.866 173.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 54.3 ttt180 -71.6 -60.63 2.13 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 114.841 1.423 . . . . 0.0 114.841 -169.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.1 t -177.55 27.56 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 119.104 -1.039 . . . . 0.0 113.79 -171.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.413 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 1.1 ptp180 -84.6 -14.12 49.66 Favored 'General case' 0 C--N 1.31 -1.149 0 C-N-CA 117.452 -1.699 . . . . 0.0 110.033 176.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--N 1.305 -1.355 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 173.567 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.929 0 N-CA-C 111.144 -0.782 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 18.6 m 61.98 29.42 17.74 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.816 0.847 . . . . 0.0 109.507 -178.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 60.0 mtt -69.84 -30.26 67.71 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.052 -172.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 40.9 m 61.56 32.23 18.7 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.797 0.808 . . . . 0.0 111.36 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 29.5 m170 -105.27 -52.99 2.73 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 121.751 0.786 . . . . 0.0 109.242 178.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -69.66 136.42 51.1 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.732 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 118.61 -49.04 0.89 Allowed Glycine 0 N--CA 1.423 -2.177 0 N-CA-C 108.484 -1.846 . . . . 0.0 108.484 -175.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -157.98 73.75 0.69 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 122.204 1.002 . . . . 0.0 108.832 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.87 -22.31 34.06 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.119 -1.4 . . . . 0.0 108.933 176.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 10.4 t -63.66 -27.31 69.14 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.76 -176.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.79 -43.42 96.38 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -71.78 -41.62 68.12 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.917 -176.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.63 -47.22 87.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.437 -0.802 . . . . 0.0 108.967 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' B' ' 118' ' ' ASP . 50.7 tp -65.37 -34.14 77.6 Favored 'General case' 0 C--O 1.19 -2.042 0 CA-C-N 114.651 -1.159 . . . . 0.0 111.43 179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 55.6 tp -65.61 -33.73 76.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.104 0.478 . . . . 0.0 109.829 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 31.3 m -64.45 -45.38 87.67 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.417 175.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' B' ' 120' ' ' LEU . 13.0 m -67.77 -35.21 78.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 121.746 0.784 . . . . 0.0 110.095 176.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 6.4 t70 -63.82 -31.95 73.29 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 125.494 1.518 . . . . 0.0 109.903 -178.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 27.0 m -64.51 -24.98 67.79 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.711 178.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . 0.402 ' HB3' ' O ' ' B' ' 117' ' ' SER . 7.7 tt -74.47 -32.4 62.56 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 121.425 0.631 . . . . 0.0 109.464 178.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 33.7 t -76.82 -15.34 59.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.369 177.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 67.26 23.31 9.4 Favored 'General case' 0 C--O 1.242 0.685 0 C-N-CA 124.073 0.949 . . . . 0.0 108.468 -173.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 50.9 m 60.04 44.19 13.53 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 114.05 -1.432 . . . . 0.0 111.51 -178.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -81.65 -53.94 5.81 Favored 'General case' 0 C--O 1.247 0.944 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.565 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 152.91 -171.72 31.95 Favored Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 109.054 -1.618 . . . . 0.0 109.054 -178.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -120.07 16.16 10.11 Favored Glycine 0 C--N 1.315 -0.634 0 C-N-CA 120.185 -1.007 . . . . 0.0 112.764 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 72.82 -157.74 52.7 Favored Glycine 0 N--CA 1.443 -0.899 0 N-CA-C 111.777 -0.529 . . . . 0.0 111.777 -178.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.6 m -97.07 129.63 44.47 Favored 'General case' 0 N--CA 1.426 -1.653 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -72.77 94.7 0.68 Allowed Glycine 0 C--N 1.313 -0.74 0 C-N-CA 120.416 -0.897 . . . . 0.0 111.952 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . 0.442 ' O ' ' HE2' ' A' ' 21' ' ' LYS . . . -114.04 -159.38 13.01 Favored Glycine 0 C--N 1.314 -0.645 0 C-N-CA 121.502 -0.38 . . . . 0.0 112.891 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 145.0 166.33 11.61 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 10.4 t -143.72 -176.74 5.09 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 118.27 1.035 . . . . 0.0 109.535 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 135.4 170.03 12.01 Favored Glycine 0 N--CA 1.442 -0.94 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -178.44 89.67 0.08 OUTLIER Glycine 0 N--CA 1.447 -0.612 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -146.92 -29.73 0.07 OUTLIER Glycine 0 N--CA 1.438 -1.217 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.517 -178.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 16.3 p -145.41 -70.5 0.27 Allowed 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 117.378 0.589 . . . . 0.0 112.297 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.634 ' O ' ' HB2' ' B' ' 141' ' ' MET . 71.9 mt -105.26 -32.85 8.43 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 120.846 0.355 . . . . 0.0 111.272 -177.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.53 -13.22 60.35 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 115.854 1.798 . . . . 0.0 115.854 -165.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 44.8 t -73.59 -39.29 64.72 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 119.159 -1.016 . . . . 0.0 110.245 -178.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -115.67 22.41 13.15 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.621 -176.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.634 ' HB2' ' O ' ' B' ' 137' ' ' LEU . 44.4 ttp -90.57 -12.84 35.87 Favored 'General case' 0 C--O 1.205 -1.244 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -171.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -38.24 -60.13 0.81 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 116.519 2.044 . . . . 0.0 116.519 -174.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.9 m -66.78 -39.67 87.89 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.22 0.533 . . . . 0.0 110.212 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 86.2 mt -64.98 -53.01 46.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.847 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.46 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 18.4 tt -68.37 -31.6 52.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 120.928 0.394 . . . . 0.0 112.061 -175.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -69.45 -51.52 35.38 Favored 'General case' 0 N--CA 1.419 -1.993 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.688 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 53.6 p -67.4 -42.45 83.28 Favored 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -80.62 -40.28 25.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -176.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.429 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 10.0 tt -98.55 -36.37 9.93 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -171.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . 0.281 4.6 ppp? -169.78 97.31 0.3 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.153 0.978 . . . . 0.0 112.602 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -97.85 12.6 33.46 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.609 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.367 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.583 -179.185 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.486 -1.772 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.3 t -81.45 116.67 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 179.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.412 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -63.6 101.49 0.35 Allowed 'General case' 0 C--N 1.299 -1.623 0 O-C-N 124.037 0.835 . . . . 0.0 111.046 178.881 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.419 ' HB2' ' NE1' ' A' ' 6' ' ' TRP . 13.8 ptpt -130.86 90.45 2.9 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.521 177.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.9 -20.25 1.77 Allowed Glycine 0 N--CA 1.473 1.136 0 C-N-CA 125.7 1.619 . . . . 0.0 116.842 -171.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.419 ' NE1' ' HB2' ' A' ' 4' ' ' LYS . 65.6 p-90 -66.12 -15.07 62.79 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 117.444 0.622 . . . . 0.0 111.562 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.556 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 8.9 p80 -59.8 -25.08 64.65 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.171 0.588 . . . . 0.0 111.634 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -84.81 -9.33 58.27 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 120.921 0.391 . . . . 0.0 110.85 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.413 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 30.2 m-70 -88.83 -8.01 55.12 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 121.389 0.614 . . . . 0.0 109.557 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.593 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -106.17 140.97 22.54 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 N-CA-C 105.664 -1.976 . . . . 0.0 105.664 177.456 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.689 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -107.18 158.47 17.07 Favored 'General case' 0 C--N 1.276 -2.624 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -51.4 -41.49 60.76 Favored 'General case' 0 N--CA 1.438 -1.034 0 O-C-N 125.352 1.657 . . . . 0.0 109.993 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 18.7 m-20 -69.34 -39.35 78.21 Favored 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.04 179.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.567 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.3 tm? -63.62 -50.53 68.99 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 -179.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.689 ' HG2' ' O ' ' A' ' 11' ' ' THR 0.261 17.3 mmm-85 -51.54 -57.92 7.74 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 123.642 0.589 . . . . 0.0 109.704 175.978 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.0 t -66.02 -26.84 67.71 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.829 -171.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.438 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 11.0 t60 -70.54 -46.93 62.66 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.567 HD12 ' O ' ' A' ' 14' ' ' LEU . 4.3 mp -68.12 -38.84 82.67 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.761 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.546 HG22 ' O ' ' A' ' 15' ' ' ARG . 73.7 t -56.76 -48.44 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 C-N-CA 123.618 0.767 . . . . 0.0 110.114 174.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -56.84 -49.01 76.71 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.682 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.536 ' HZ1' HG13 ' B' ' 145' ' ' ILE . 84.2 mttt -63.43 -39.83 95.52 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.769 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.494 ' O ' HG23 ' A' ' 26' ' ' ILE . 5.7 mt -51.01 -52.84 38.9 Favored 'General case' 0 CA--C 1.506 -0.75 0 O-C-N 123.99 0.806 . . . . 0.0 110.577 174.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.448 HG13 ' HE2' ' A' ' 40' ' ' MET . 59.3 t -55.54 -51.24 60.0 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.17 0 O-C-N 124.031 0.832 . . . . 0.0 110.38 176.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -54.62 -35.94 63.96 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -175.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.2 -45.54 16.18 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 178.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.527 HG22 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.97 -23.84 15.05 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 CA-C-O 122.251 1.024 . . . . 0.0 110.925 -174.834 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.527 ' CD2' HG22 ' A' ' 26' ' ' ILE . 63.0 m-85 -134.32 94.57 17.52 Favored Pre-proline 0 C--N 1.282 -2.358 0 C-N-CA 124.85 1.26 . . . . 0.0 107.735 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.96 89.54 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 121.906 1.737 . . . . 0.0 110.655 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -59.3 128.96 86.29 Favored Pre-proline 0 N--CA 1.429 -1.49 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.307 -174.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -73.78 -17.75 22.62 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 123.082 2.521 . . . . 0.0 112.059 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -160.13 146.36 11.86 Favored Pre-proline 0 CA--C 1.492 -1.282 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -61.35 -19.01 62.35 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 121.997 1.798 . . . . 0.0 113.913 176.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.05 -11.84 59.74 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.5 -0.88 . . . . 0.0 111.818 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.05 -6.61 53.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.862 0.839 . . . . 0.0 109.523 175.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.48 ' O ' ' HG2' ' A' ' 40' ' ' MET . 24.6 mt -91.36 0.9 57.45 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.059 -178.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -133.3 18.8 4.01 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 122.195 0.998 . . . . 0.0 108.63 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.567 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 27.9 t70 -96.29 177.18 5.79 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 113.811 -1.541 . . . . 0.0 112.041 -173.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.567 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.96 -25.11 62.58 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 124.203 1.001 . . . . 0.0 111.058 179.173 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.572 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 43.0 ttm180 -76.11 -27.84 57.25 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 176.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.826 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 10.7 tpp -59.02 -36.64 75.3 Favored 'General case' 0 C--O 1.197 -1.675 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.167 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.495 ' O ' ' HB3' ' A' ' 45' ' ' ALA . 9.4 pt-20 -59.24 -32.97 70.46 Favored 'General case' 0 C--O 1.189 -2.103 0 C-N-CA 119.558 -0.857 . . . . 0.0 109.952 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -76.57 -43.33 39.32 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 123.23 0.612 . . . . 0.0 110.465 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.0 mt -63.26 -48.62 77.44 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.199 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.826 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.3 p -73.28 -28.33 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.719 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.137 -178.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 41' ' ' GLU . . . -59.81 -45.67 91.64 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.52 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 13.0 t80 -61.79 -47.86 83.23 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.917 174.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.06 -43.05 91.67 Favored 'General case' 0 C--O 1.203 -1.372 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.234 -178.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -66.06 -39.96 90.51 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 123.7 0.8 . . . . 0.0 112.181 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -69.84 -37.36 76.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.359 0.599 . . . . 0.0 109.712 -178.287 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.411 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 65.3 t -70.98 -50.0 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.101 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.416 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.5 tm-20 -57.11 -46.79 82.33 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.964 0.906 . . . . 0.0 109.575 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.67 -40.47 98.04 Favored Glycine 0 CA--C 1.507 -0.413 0 O-C-N 123.587 0.555 . . . . 0.0 112.235 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -59.66 -54.34 47.58 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 122.785 0.434 . . . . 0.0 110.799 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.451 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.0 OUTLIER -64.99 -34.17 77.81 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 178.118 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.556 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 68.1 t80 -59.48 -52.74 64.28 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 174.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.84 -18.55 61.44 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-O 121.705 0.764 . . . . 0.0 111.837 -179.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.451 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 17.4 m -85.46 -27.16 25.89 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -87.55 167.23 14.12 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -176.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -108.6 5.83 25.37 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.641 177.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.526 ' HB2' ' OD1' ' A' ' 62' ' ' ASP . 42.0 p -169.87 154.33 5.22 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 178.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.593 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -62.46 -36.24 81.82 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-O 121.247 0.546 . . . . 0.0 110.51 179.859 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.526 ' OD1' ' HB2' ' A' ' 60' ' ' SER . 1.2 p-10 -62.79 -38.62 91.4 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 124.548 1.139 . . . . 0.0 111.202 177.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -70.57 -44.35 67.58 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.705 0.288 . . . . 0.0 110.874 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -43.83 85.26 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.331 -177.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.64 -40.11 93.72 Favored 'General case' 0 C--O 1.199 -1.566 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.514 176.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -60.2 -57.73 11.57 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.238 0.336 . . . . 0.0 111.633 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.445 HD12 ' CB ' ' A' ' 54' ' ' MET . 4.7 pp -69.1 -30.43 68.72 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.717 -174.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.506 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -76.08 -32.57 59.31 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 119.85 -0.74 . . . . 0.0 109.073 178.366 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.428 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -66.47 -36.8 83.66 Favored 'General case' 0 C--O 1.206 -1.234 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.37 -44.14 92.34 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.757 177.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.554 ' O ' HD12 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.96 -39.05 79.71 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 119.966 -0.694 . . . . 0.0 111.137 179.011 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.428 HG21 ' HA ' ' A' ' 69' ' ' ALA . 10.5 tt -68.91 -40.61 81.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.302 -179.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.548 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.1 t80 -57.49 -51.22 70.33 Favored 'General case' 0 C--O 1.261 1.669 0 C-N-CA 124.711 1.204 . . . . 0.0 111.303 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.8 ptpt -63.53 -40.6 97.44 Favored 'General case' 0 C--O 1.199 -1.565 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.554 HD12 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -60.7 -38.77 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 O-C-N 123.717 0.636 . . . . 0.0 111.01 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.513 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 28.1 mt-30 -69.26 -45.0 70.8 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 120.265 -0.574 . . . . 0.0 111.855 -177.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 10.9 ptpt -74.35 -27.6 60.75 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 118.858 -1.137 . . . . 0.0 112.362 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.528 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 7.1 tp10 -61.02 -49.2 78.38 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 174.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -65.9 -42.13 90.63 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -177.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.507 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 9.6 pt-20 -69.48 -39.18 77.81 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 119.444 -0.903 . . . . 0.0 112.652 -177.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -69.44 -39.59 77.73 Favored 'General case' 0 C--O 1.213 -0.817 0 C-N-CA 118.877 -1.129 . . . . 0.0 110.534 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.467 ' HA ' ' HD2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -69.25 -31.66 70.35 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 120.564 -0.454 . . . . 0.0 111.016 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 5.5 mmt180 -77.1 -46.61 22.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.913 178.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 22.8 tpt180 -90.61 -58.48 2.47 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 -173.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 26.8 p -165.49 97.29 0.68 Allowed 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -173.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.467 ' HD2' ' HA ' ' A' ' 82' ' ' LYS . 5.0 ptm180 -126.97 -30.65 2.7 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 119.816 -0.753 . . . . 0.0 109.362 172.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 C--O 1.251 1.133 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.026 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.953 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 49.1 m 62.15 25.22 15.08 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.532 1.133 . . . . 0.0 112.677 178.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 27.8 ttt -76.37 -30.69 57.66 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 36.1 m -111.01 136.31 50.22 Favored 'General case' 0 N--CA 1.422 -1.856 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 174.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . 0.427 ' O ' ' HB3' ' B' ' 109' ' ' GLN . 69.0 m80 -86.73 119.17 26.68 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -93.29 -11.92 31.33 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.649 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -71.81 99.25 0.83 Allowed Glycine 0 CA--C 1.496 -1.096 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 176.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 58.59 47.0 13.89 Favored 'General case' 0 C--O 1.249 1.055 0 CA-C-O 121.606 0.717 . . . . 0.0 110.236 -174.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' B' ' 105' ' ' HIS . 3.2 pp0? -59.15 -29.77 67.68 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.54 177.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 3.5 m -55.35 -53.19 59.29 Favored 'General case' 0 N--CA 1.419 -1.992 0 C-N-CA 125.075 1.35 . . . . 0.0 110.8 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.34 -47.0 68.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.604 -176.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.452 ' O ' HG22 ' B' ' 116' ' ' THR . 11.7 pt20 -68.18 -42.29 80.19 Favored 'General case' 0 C--O 1.246 0.914 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -176.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.39 -41.03 94.14 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.431 HD22 ' HB3' ' A' ' 79' ' ' LEU . 56.0 tp -73.35 -29.08 62.42 Favored 'General case' 0 C--O 1.208 -1.123 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.745 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.413 HD13 ' HD3' ' A' ' 82' ' ' LYS . 61.8 tp -71.22 -38.4 72.0 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.372 -0.83 . . . . 0.0 110.463 178.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.452 HG22 ' O ' ' B' ' 112' ' ' GLN . 3.1 t -71.32 -35.84 71.37 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 119.834 -0.746 . . . . 0.0 111.644 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.1 p -69.84 -33.33 72.15 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.595 0.712 . . . . 0.0 109.874 175.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 11.9 t70 -62.91 -36.19 82.57 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 124.621 1.168 . . . . 0.0 109.976 176.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 30.0 m -65.77 -20.43 66.26 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.643 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 7.6 tt -71.16 -33.53 70.11 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 123.076 0.55 . . . . 0.0 110.406 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 9.4 m -76.47 -30.09 57.17 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.196 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 70.17 -62.18 0.44 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.2 1.4 . . . . 0.0 112.523 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 12.5 p -74.02 177.61 5.55 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 123.986 0.915 . . . . 0.0 113.385 -173.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -108.47 104.58 13.95 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.442 -178.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 160.93 174.73 31.14 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.501 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -146.29 105.14 0.32 Allowed Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -90.62 98.92 2.51 Favored Glycine 0 N--CA 1.442 -0.952 0 C-N-CA 121.199 -0.524 . . . . 0.0 113.359 -175.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 22.8 t -88.81 156.58 18.87 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -170.9 44.92 0.19 Allowed Glycine 0 N--CA 1.438 -1.17 0 N-CA-C 110.286 -1.125 . . . . 0.0 110.286 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -94.85 -113.71 2.63 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.554 -0.832 . . . . 0.0 112.099 -176.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 160.2 -169.31 36.04 Favored Glycine 0 N--CA 1.433 -1.506 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 -179.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 24.2 p -151.71 150.66 30.47 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 116.829 0.315 . . . . 0.0 110.28 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 147.66 150.08 5.11 Favored Glycine 0 N--CA 1.438 -1.198 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 165.96 -63.62 0.22 Allowed Glycine 0 C--N 1.296 -1.681 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 123.04 16.53 3.56 Favored Glycine 0 N--CA 1.434 -1.457 0 C-N-CA 121.367 -0.444 . . . . 0.0 112.745 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 24.5 m -118.66 -90.65 0.57 Allowed 'General case' 0 N--CA 1.423 -1.819 0 O-C-N 122.507 -0.408 . . . . 0.0 111.4 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.439 ' HB2' ' CD2' ' A' ' 14' ' ' LEU . 82.0 mt -107.07 -41.71 5.09 Favored 'General case' 0 C--O 1.204 -1.339 0 CA-C-O 121.412 0.625 . . . . 0.0 110.118 -177.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.23 -26.78 41.78 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 126.696 1.998 . . . . 0.0 113.984 -175.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 5.0 p -86.9 -12.11 48.69 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-O 121.135 0.493 . . . . 0.0 111.916 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -130.58 31.5 4.54 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 -176.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.549 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 21.1 ttt -100.81 -26.48 13.75 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 113.684 -1.598 . . . . 0.0 113.157 -166.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -34.26 -59.99 0.42 Allowed 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -172.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.4 m -69.22 -38.3 78.48 Favored 'General case' 0 C--O 1.253 1.247 0 CA-C-O 121.587 0.708 . . . . 0.0 110.43 -176.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 58.6 mt -69.94 -46.77 72.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.415 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.549 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 0.0 OUTLIER -63.56 -36.65 77.16 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.76 -179.051 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -61.4 -65.41 0.7 Allowed 'General case' 0 N--CA 1.428 -1.575 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.395 178.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.2 p -64.2 -54.02 40.08 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -173.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -80.78 -35.14 33.56 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -173.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.416 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 10.1 tt -94.6 -33.05 13.16 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -171.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 25.8 ptt? -157.5 26.91 0.29 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 116.081 -2.248 . . . . 0.0 115.033 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 15.4 t70 79.17 -77.18 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 125.617 1.567 . . . . 0.0 113.39 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.843 0 CA-C-O 118.966 -0.54 . . . . 0.0 111.377 -176.861 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.371 0 CA-C-O 119.958 -0.357 . . . . 0.0 112.895 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.3 m -136.05 154.69 34.09 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 CA-C-N 118.128 0.964 . . . . 0.0 111.385 -178.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.56 111.33 16.66 Favored 'General case' 0 N--CA 1.423 -1.8 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 175.123 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.41 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 10.8 ptpt -152.69 104.72 2.9 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.772 -177.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.18 -22.28 13.6 Favored Glycine 0 CA--C 1.521 0.44 0 CA-C-N 114.338 -1.301 . . . . 0.0 115.83 -175.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.41 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 56.9 p-90 -64.37 -9.41 17.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 117.734 0.767 . . . . 0.0 112.279 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -62.58 -17.04 59.27 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 122.382 0.273 . . . . 0.0 111.621 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -86.44 -10.5 54.1 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.268 0.556 . . . . 0.0 110.359 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.421 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 24.7 m-70 -87.98 5.94 38.33 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.68 0.752 . . . . 0.0 109.575 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.593 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -133.51 114.01 19.86 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.703 0 N-CA-C 105.285 -2.117 . . . . 0.0 105.285 178.564 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.72 174.74 7.84 Favored 'General case' 0 C--N 1.276 -2.592 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -28.79 70.33 Favored 'General case' 0 C--O 1.202 -1.399 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -57.72 -48.25 80.11 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 178.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.546 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.4 tm? -66.4 -54.45 24.21 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -175.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.545 ' O ' HG21 ' A' ' 19' ' ' VAL . 2.8 ptm180 -60.9 -45.16 95.7 Favored 'General case' 0 N--CA 1.42 -1.956 0 CA-C-N 114.629 -1.169 . . . . 0.0 113.996 -178.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.1 t -65.3 -30.35 71.2 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 117.816 0.28 . . . . 0.0 110.756 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -66.31 -45.16 81.27 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.546 HD11 ' O ' ' A' ' 14' ' ' LEU . 6.3 mp -66.33 -40.23 89.75 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.497 178.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.545 HG21 ' O ' ' A' ' 15' ' ' ARG . 53.5 t -58.98 -49.75 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 124.022 0.929 . . . . 0.0 110.271 175.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -54.84 -44.13 73.66 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.969 0.908 . . . . 0.0 110.04 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -67.96 -41.64 82.14 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.103 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.488 ' O ' HG23 ' A' ' 26' ' ' ILE . 55.5 mt -51.91 -48.03 64.36 Favored 'General case' 0 CA--C 1.501 -0.909 0 O-C-N 123.515 0.509 . . . . 0.0 110.025 175.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.433 HG12 ' HE3' ' A' ' 40' ' ' MET . 41.8 t -55.81 -55.42 17.91 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.881 0 O-C-N 124.284 0.99 . . . . 0.0 110.471 175.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -57.21 -29.7 63.95 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -176.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.48 -45.91 15.3 Favored 'General case' 0 C--O 1.21 -1.007 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 176.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.488 HG23 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.86 -26.31 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-O 121.961 0.886 . . . . 0.0 110.141 -174.461 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.496 ' CD2' HD22 ' A' ' 43' ' ' LEU . 14.4 m-85 -138.81 88.09 14.07 Favored Pre-proline 0 N--CA 1.418 -2.058 0 C-N-CA 125.394 1.477 . . . . 0.0 108.717 177.147 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -57.09 106.33 0.22 Allowed 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 121.74 1.626 . . . . 0.0 109.214 177.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.0 t -66.85 130.08 94.0 Favored Pre-proline 0 N--CA 1.422 -1.833 0 CA-C-O 121.161 0.505 . . . . 0.0 111.164 -174.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.91 -31.6 12.42 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.534 2.156 . . . . 0.0 111.696 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -144.81 148.1 37.94 Favored Pre-proline 0 CA--C 1.49 -1.344 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 -176.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -69.12 -12.98 35.44 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.566 1.511 . . . . 0.0 112.286 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.64 -14.53 48.35 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.408 177.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.83 -11.19 60.5 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.877 0.846 . . . . 0.0 109.037 176.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.434 ' HA ' ' CE ' ' A' ' 40' ' ' MET . 23.9 mt -86.92 5.47 36.9 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.414 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -136.12 6.64 3.11 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.82 -0.55 . . . . 0.0 111.556 173.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.637 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 30.9 t70 -81.31 177.56 8.92 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.698 -176.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.637 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.93 -19.3 62.59 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.566 0.698 . . . . 0.0 110.468 175.225 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.604 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 17.3 tpp180 -70.3 -31.94 69.5 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.571 ' O ' HG21 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -57.95 -41.01 81.95 Favored 'General case' 0 CA--C 1.478 -1.803 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.149 -179.424 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 7.7 pt-20 -60.15 -33.98 72.91 Favored 'General case' 0 C--O 1.208 -1.122 0 O-C-N 123.785 0.678 . . . . 0.0 110.763 -175.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.467 HD21 HD21 ' A' ' 43' ' ' LEU . 6.9 t30 -73.6 -44.66 56.58 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.38 0.609 . . . . 0.0 109.901 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 8.8 mt -65.53 -45.73 82.35 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.262 -176.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.571 HG21 ' O ' ' A' ' 40' ' ' MET . 29.1 m -69.33 -31.45 49.6 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.139 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.205 178.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.56 -45.2 89.48 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 177.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.506 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.4 t80 -63.17 -48.6 77.72 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.57 0.544 . . . . 0.0 110.373 173.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.83 -42.04 88.29 Favored 'General case' 0 C--O 1.201 -1.499 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.188 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 64.5 mttm -68.36 -41.12 81.1 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 123.843 0.857 . . . . 0.0 111.669 178.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.506 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 57.3 pttt -67.06 -39.33 86.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.728 0.775 . . . . 0.0 109.546 -178.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.453 HG22 ' CE2' ' A' ' 46' ' ' TYR . 42.9 t -72.54 -45.9 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.14 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.416 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.7 tm-20 -58.02 -47.53 82.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 177.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.89 -39.35 95.38 Favored Glycine 0 N--CA 1.449 -0.48 0 O-C-N 123.646 0.591 . . . . 0.0 112.436 178.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -59.09 -54.26 49.03 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 123.703 0.801 . . . . 0.0 110.741 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.449 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.4 OUTLIER -69.98 -28.33 65.45 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 178.123 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -66.25 -47.55 73.4 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -73.48 -26.4 60.89 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.187 0.517 . . . . 0.0 111.334 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 25.6 m -75.89 -33.04 59.92 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.27 170.39 15.45 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.432 0.634 . . . . 0.0 112.237 -178.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -120.18 13.15 11.98 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.423 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.8 p -166.86 152.85 8.15 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.593 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -64.75 -27.4 68.87 Favored 'General case' 0 C--O 1.204 -1.328 0 C-N-CA 118.43 -1.308 . . . . 0.0 110.22 175.328 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -63.07 -47.71 81.75 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.78 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.1 -44.27 89.36 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.317 176.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -45.35 86.51 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.583 -177.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.54 -41.99 98.16 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.215 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 -60.66 -52.69 64.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.497 ' O ' ' HB2' ' A' ' 70' ' ' GLU . 4.5 pp -72.04 -33.74 68.22 Favored 'General case' 0 C--O 1.264 1.848 0 CA-C-O 121.305 0.574 . . . . 0.0 111.969 -175.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.473 HD23 HD22 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -70.76 -36.5 73.13 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 179.2 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.464 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -60.94 -39.87 91.08 Favored 'General case' 0 C--O 1.188 -2.151 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.316 175.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 42.5 mm-40 -55.77 -51.37 67.64 Favored 'General case' 0 C--O 1.253 1.282 0 C-N-CA 122.697 0.399 . . . . 0.0 111.704 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.81 -39.01 76.79 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 118.63 -1.228 . . . . 0.0 111.924 -177.486 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.464 HG22 ' HA ' ' A' ' 69' ' ' ALA . 8.4 tt -67.65 -45.19 85.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.662 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.546 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 47.7 t80 -54.95 -51.88 64.75 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 125.571 1.548 . . . . 0.0 110.684 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.531 ' HB3' ' HZ3' ' A' ' 74' ' ' LYS . 0.4 OUTLIER -63.21 -41.22 99.12 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 120.471 -0.492 . . . . 0.0 110.53 -179.387 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -62.83 -35.05 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 O-C-N 123.177 0.298 . . . . 0.0 111.45 178.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.517 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 5.1 mt-30 -70.75 -44.29 67.08 Favored 'General case' 0 CA--C 1.483 -1.634 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.867 -177.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 12.4 ptpt -74.55 -27.4 60.5 Favored 'General case' 0 N--CA 1.418 -2.027 0 C-N-CA 119.017 -1.073 . . . . 0.0 111.898 176.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -67.46 -42.71 82.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 176.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -65.98 -39.34 90.27 Favored 'General case' 0 C--O 1.212 -0.878 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.088 177.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -58.4 -52.72 64.44 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 123.726 0.641 . . . . 0.0 111.111 176.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.41 -43.23 95.02 Favored 'General case' 0 C--O 1.211 -0.926 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.982 -178.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.409 ' C ' ' HD2' ' A' ' 82' ' ' LYS . 0.2 OUTLIER -67.4 -33.47 75.25 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.122 0.486 . . . . 0.0 110.677 -177.799 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -75.12 -45.46 40.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.622 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -80.76 -60.34 2.34 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 -176.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.3 p 175.65 84.04 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -175.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -94.97 -23.82 17.22 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 119.279 -0.968 . . . . 0.0 109.547 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--O 1.254 1.304 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.833 175.734 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 14.7 m -87.88 111.94 21.97 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 114.549 -0.826 . . . . 0.0 109.342 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 89.4 mtp -81.14 -2.73 49.58 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.14 0.792 . . . . 0.0 113.14 -173.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 9.8 t -131.02 25.21 4.95 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.083 0.468 . . . . 0.0 109.99 -178.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -95.01 127.42 41.06 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.557 -0.857 . . . . 0.0 108.701 178.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 71.95 126.95 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.96 1.304 . . . . 0.0 111.382 -174.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.66 87.06 1.04 Allowed Glycine 0 N--CA 1.433 -1.546 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -175.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 10.7 t30 71.14 7.13 6.07 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 122.606 1.193 . . . . 0.0 110.182 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -76.44 -27.73 56.32 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.089 -178.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 10.1 t -69.12 -30.24 68.46 Favored 'General case' 0 N--CA 1.428 -1.559 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 56.9 tp -74.47 -47.8 31.19 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.566 0.222 . . . . 0.0 110.827 178.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -71.14 -31.66 68.01 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.408 -0.917 . . . . 0.0 112.132 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -70.21 -35.15 73.71 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.456 HD22 ' HB3' ' A' ' 79' ' ' LEU . 26.5 tp -66.07 -31.91 73.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.543 175.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 40.2 tp -70.12 -33.42 71.81 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 32.3 m -64.64 -43.09 94.8 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 174.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.6 m -61.58 -41.99 98.2 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.429 0.633 . . . . 0.0 109.761 176.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -56.64 -43.58 80.44 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 124.144 0.977 . . . . 0.0 110.788 176.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 23.5 t -68.25 -15.7 63.67 Favored 'General case' 0 CA--C 1.558 1.265 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.412 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 9.2 tt -89.23 -30.3 18.61 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 176.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 19.0 t -76.5 -47.46 22.71 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.845 -178.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 44.8 m80 75.86 -51.94 0.63 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.203 1.401 . . . . 0.0 112.404 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 20.5 t -108.46 165.5 11.47 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.98 -0.45 . . . . 0.0 110.064 -176.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -84.49 80.9 9.07 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -91.04 -102.8 1.27 Allowed Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.822 -176.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 82.91 -140.81 20.44 Favored Glycine 0 N--CA 1.436 -1.319 0 N-CA-C 111.784 -0.526 . . . . 0.0 111.784 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 158.66 -27.32 0.41 Allowed Glycine 0 C--N 1.304 -1.218 0 N-CA-C 109.997 -1.241 . . . . 0.0 109.997 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 5.1 t 78.33 -47.73 0.45 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.949 1.699 . . . . 0.0 111.056 175.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 95.44 110.32 2.44 Favored Glycine 0 N--CA 1.441 -1.03 0 C-N-CA 120.985 -0.626 . . . . 0.0 113.693 176.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -142.47 168.99 25.65 Favored Glycine 0 C--N 1.297 -1.591 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 99.31 44.08 2.43 Favored Glycine 0 C--N 1.301 -1.375 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.526 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.9 p -71.23 137.83 48.98 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.639 0.257 . . . . 0.0 110.486 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -150.06 145.88 14.43 Favored Glycine 0 N--CA 1.431 -1.683 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 148.26 -142.97 10.51 Favored Glycine 0 N--CA 1.438 -1.224 0 C-N-CA 121.289 -0.481 . . . . 0.0 112.021 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -110.32 -115.45 3.65 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.128 -0.558 . . . . 0.0 114.129 -175.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 43.4 t -25.35 -75.84 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 126.776 2.03 . . . . 0.0 115.309 -174.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 67.0 mt -101.94 -15.39 16.85 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.918 0.866 . . . . 0.0 108.845 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.503 ' HG2' ' HB2' ' A' ' 14' ' ' LEU . 2.9 mt-10 -83.38 -16.24 46.74 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 113.565 -1.652 . . . . 0.0 112.003 -164.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 42.1 t -41.08 -59.78 1.39 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.139 1.376 . . . . 0.0 112.128 -176.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -169.93 83.94 0.12 Allowed 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 123.217 1.484 . . . . 0.0 107.867 173.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 16.0 ptm -92.72 -11.35 34.19 Favored 'General case' 0 C--N 1.291 -1.957 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.157 -173.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -10.4 -74.18 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 128.196 2.598 . . . . 0.0 115.554 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 5.7 m -66.54 -47.48 72.74 Favored 'General case' 0 C--O 1.253 1.251 0 C-N-CA 123.589 0.756 . . . . 0.0 112.191 -175.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 62.5 mt -65.62 -44.49 93.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.887 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 12.0 tt -67.49 -36.63 76.92 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.481 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.855 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 45.6 ttt180 -55.71 -50.5 70.14 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.9 m -60.97 -51.86 67.46 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.651 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -76.52 -43.32 39.88 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -174.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.521 HD13 ' SD ' ' B' ' 150' ' ' MET . 2.5 tm? -75.34 -42.69 53.76 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.721 -172.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.521 ' SD ' HD13 ' B' ' 149' ' ' LEU . 0.0 OUTLIER -161.29 33.12 0.14 Allowed 'General case' 0 C--O 1.247 0.968 0 N-CA-C 116.169 1.914 . . . . 0.0 116.169 -175.331 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.81 121.06 15.18 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 118.9 -1.12 . . . . 0.0 110.765 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.846 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.378 -178.392 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.488 -1.625 0 N-CA-C 111.888 -0.485 . . . . 0.0 111.888 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.402 ' HB ' ' NZ ' ' A' ' 4' ' ' LYS . 21.6 t -132.54 125.17 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.589 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 178.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.63 112.64 24.65 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.436 ' HD2' ' HE1' ' A' ' 6' ' ' TRP . 28.8 mtmm -121.59 119.78 32.89 Favored 'General case' 0 C--N 1.28 -2.443 0 CA-C-N 114.531 -1.213 . . . . 0.0 108.578 -174.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -52.2 -25.1 17.56 Favored Glycine 0 C--O 1.243 0.709 0 N-CA-C 116.023 1.169 . . . . 0.0 116.023 -172.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.436 ' HE1' ' HD2' ' A' ' 4' ' ' LYS . 66.2 p-90 -66.59 -14.72 62.75 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 117.412 0.606 . . . . 0.0 112.009 178.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.404 ' HB2' ' HH ' ' A' ' 55' ' ' TYR . 0.7 OUTLIER -59.39 -14.12 10.92 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 177.12 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -84.86 -10.26 57.31 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.46 0.648 . . . . 0.0 110.422 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -95.04 3.58 54.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.211 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.0 p -134.74 125.85 46.75 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.021 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.459 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -93.84 157.83 15.94 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.52 -177.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -43.05 64.6 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.071 0.948 . . . . 0.0 110.049 175.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.414 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 1.9 m-20 -57.47 -37.23 72.55 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.245 -0.888 . . . . 0.0 112.191 -179.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.464 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.3 tm? -70.4 -51.45 29.48 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 -176.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.494 ' O ' HG21 ' A' ' 19' ' ' VAL . 3.9 ptm180 -66.17 -43.73 86.08 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.447 -1.251 . . . . 0.0 113.164 -176.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.5 t -68.42 -24.46 64.74 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-O 121.181 0.515 . . . . 0.0 109.672 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.414 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 20.2 t60 -68.92 -44.58 72.84 Favored 'General case' 0 C--O 1.246 0.915 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 176.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.494 HD21 HD23 ' A' ' 68' ' ' LEU . 3.7 mp -65.78 -40.65 92.2 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.705 -1.134 . . . . 0.0 110.171 177.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.494 HG21 ' O ' ' A' ' 15' ' ' ARG . 60.6 t -55.69 -48.46 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.602 0.761 . . . . 0.0 110.101 174.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -53.65 -50.43 65.78 Favored 'General case' 0 C--O 1.249 1.053 0 C-N-CA 123.622 0.769 . . . . 0.0 110.607 177.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -64.14 -39.8 94.8 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.814 178.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.533 ' O ' HG23 ' A' ' 26' ' ' ILE . 20.2 mt -50.96 -53.34 33.87 Favored 'General case' 0 CA--C 1.505 -0.782 0 O-C-N 123.797 0.686 . . . . 0.0 110.559 175.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.415 HG12 ' HE1' ' A' ' 40' ' ' MET . 54.7 t -54.8 -50.11 63.77 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.766 0 O-C-N 124.173 0.921 . . . . 0.0 110.786 176.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -55.34 -38.79 69.23 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -177.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.16 -44.56 17.7 Favored 'General case' 0 C--O 1.206 -1.235 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.834 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.574 HG22 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.22 -25.92 16.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.529 0.681 . . . . 0.0 110.725 -175.0 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.574 ' CD2' HG22 ' A' ' 26' ' ' ILE . 62.9 m-85 -128.54 91.51 43.41 Favored Pre-proline 0 C--N 1.293 -1.888 0 C-N-CA 123.858 0.863 . . . . 0.0 109.446 178.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.84 97.52 0.18 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 122.081 1.854 . . . . 0.0 110.172 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.6 t -69.73 138.37 88.17 Favored Pre-proline 0 N--CA 1.424 -1.762 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.512 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.53 -34.99 8.63 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 122.515 2.143 . . . . 0.0 111.376 178.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -142.92 150.84 54.58 Favored Pre-proline 0 CA--C 1.489 -1.381 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -65.82 -13.39 39.6 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.1 1.866 . . . . 0.0 112.088 175.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.4 -9.71 55.76 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.369 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.37 -8.77 59.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.378 1.085 . . . . 0.0 108.564 176.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.441 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.2 mt -85.6 1.57 48.61 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 114.033 -1.439 . . . . 0.0 110.291 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -133.32 20.07 4.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 122.2 1.0 . . . . 0.0 108.699 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.67 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 27.1 t70 -98.03 177.09 5.53 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.642 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.67 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -68.69 -29.03 67.38 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.725 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.569 ' O ' HD13 ' A' ' 43' ' ' LEU . 4.3 tpm_? -63.95 -34.45 78.0 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.603 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.9 tpp -58.54 -32.73 69.15 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 114.266 -1.334 . . . . 0.0 112.724 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -64.36 -31.61 72.89 Favored 'General case' 0 C--O 1.203 -1.358 0 C-N-CA 118.727 -1.189 . . . . 0.0 109.845 -178.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -72.77 -46.08 55.24 Favored 'General case' 0 CA--C 1.5 -0.949 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 175.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.569 HD13 ' O ' ' A' ' 39' ' ' ARG . 1.7 mp -53.19 -55.97 20.04 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 113.928 -1.487 . . . . 0.0 110.744 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.603 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.0 p -73.26 -29.08 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.034 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.571 -175.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.79 -47.67 84.78 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.514 ' CZ ' HG21 ' A' ' 50' ' ' VAL . 3.0 t80 -61.15 -46.56 90.01 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.148 175.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.48 -44.45 93.04 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 120.854 -0.339 . . . . 0.0 111.21 -177.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -62.83 -46.24 88.83 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 123.32 0.648 . . . . 0.0 111.829 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.5 pttp -63.55 -41.84 98.41 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-O 121.306 0.574 . . . . 0.0 110.605 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.514 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 50.8 t -70.47 -43.56 77.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.053 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -58.48 -44.6 89.4 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.7 -42.49 96.34 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.179 178.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.35 -54.62 44.66 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.464 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -67.02 -30.21 70.24 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 179.612 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.404 ' HH ' ' HB2' ' A' ' 7' ' ' HIS . 61.5 t80 -65.6 -50.74 63.98 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 176.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.426 ' CD ' ' HZ3' ' A' ' 4' ' ' LYS . 20.0 mm-40 -69.4 -25.12 63.98 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.246 -0.434 . . . . 0.0 112.07 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.435 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 34.5 m -79.18 -27.25 42.63 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 124.408 1.083 . . . . 0.0 113.431 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.19 162.82 16.47 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -110.71 8.32 22.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.54 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.6 p -162.49 157.97 23.02 Favored 'General case' 0 CA--C 1.487 -1.452 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 174.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.1 -26.45 62.15 Favored 'General case' 0 C--O 1.2 -1.515 0 C-N-CA 118.921 -1.112 . . . . 0.0 110.131 178.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -64.72 -45.3 87.13 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.502 176.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -63.26 -44.56 94.81 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.022 175.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -46.45 79.18 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.694 -177.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.423 ' HH ' HD11 ' B' ' 145' ' ' ILE . 2.2 t80 -61.86 -44.79 96.12 Favored 'General case' 0 C--O 1.209 -1.056 0 O-C-N 123.839 0.712 . . . . 0.0 110.318 177.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.454 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 13.8 t60 -65.46 -47.16 77.09 Favored 'General case' 0 C--O 1.209 -1.038 0 O-C-N 123.157 0.286 . . . . 0.0 111.475 -177.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.406 HD12 ' CB ' ' A' ' 54' ' ' MET . 4.0 pp -70.5 -33.23 70.98 Favored 'General case' 0 C--O 1.255 1.381 0 C-N-CA 120.256 -0.578 . . . . 0.0 111.528 -176.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.499 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 0.8 OUTLIER -73.23 -33.6 65.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 178.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.568 ' O ' ' HB2' ' A' ' 73' ' ' TYR . . . -63.7 -41.97 98.04 Favored 'General case' 0 C--O 1.183 -2.439 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.906 175.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 38.3 mm-40 -57.11 -47.37 81.25 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-O 121.462 0.649 . . . . 0.0 111.314 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -70.23 -38.62 75.26 Favored 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.908 -178.149 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.436 HG21 ' HA ' ' A' ' 69' ' ' ALA . 9.4 tt -69.68 -36.57 71.0 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-O 121.765 0.793 . . . . 0.0 109.794 -179.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.617 ' CD2' ' HA ' ' B' ' 150' ' ' MET . 16.9 t80 -58.55 -55.44 34.99 Favored 'General case' 0 C--O 1.279 2.646 0 C-N-CA 126.656 1.983 . . . . 0.0 109.826 -178.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.7 ptpt -64.87 -33.14 75.29 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.793 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -68.11 -41.79 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 O-C-N 123.481 0.488 . . . . 0.0 111.905 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.555 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 29.1 mt-30 -62.42 -49.01 77.17 Favored 'General case' 0 C--O 1.262 1.745 0 CA-C-O 121.198 0.523 . . . . 0.0 111.253 -178.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.2 ptpt -69.33 -31.18 69.46 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 118.75 -1.18 . . . . 0.0 111.848 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 11.4 tp10 -64.99 -47.53 77.19 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -60.4 -43.72 96.41 Favored 'General case' 0 CA--C 1.492 -1.285 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.493 -177.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.418 ' N ' HD12 ' A' ' 79' ' ' LEU . 11.5 pt-20 -67.1 -39.15 86.66 Favored 'General case' 0 C--O 1.258 1.52 0 C-N-CA 119.35 -0.94 . . . . 0.0 112.214 -178.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -73.8 -39.26 64.23 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 119.892 -0.723 . . . . 0.0 112.211 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.489 ' C ' ' HD2' ' A' ' 82' ' ' LYS . 0.2 OUTLIER -73.44 -31.93 64.1 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 110.971 -179.429 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -66.86 -40.65 87.94 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -77.72 -59.59 2.72 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 119.89 -0.724 . . . . 0.0 110.311 178.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.4 p -178.68 97.43 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -176.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -121.75 -26.1 4.93 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 171.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 C--O 1.246 0.907 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 177.245 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.805 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' SER . . . . . 0.433 ' OG ' ' HB2' ' B' ' 105' ' ' HIS . 33.0 t -124.47 110.67 14.79 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -178.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 91.1 mmm -89.88 -28.8 19.0 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.628 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 25.4 p -143.33 -50.19 0.33 Allowed 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.305 -177.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . 0.549 ' O ' ' HB3' ' B' ' 109' ' ' GLN . 39.5 t60 68.91 22.3 7.18 Favored 'General case' 0 C--N 1.35 0.629 0 CA-C-O 122.727 1.251 . . . . 0.0 108.267 -176.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -128.03 113.34 15.68 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.24 -30.81 8.83 Favored Glycine 0 C--N 1.301 -1.384 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -123.11 9.59 9.3 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -177.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . 0.549 ' HB3' ' O ' ' B' ' 105' ' ' HIS . 4.6 pm0 -60.39 -37.93 82.35 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.169 0.509 . . . . 0.0 110.077 -179.442 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 12.8 t -70.82 -34.48 71.75 Favored 'General case' 0 N--CA 1.416 -2.128 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.283 -173.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -66.71 -45.02 80.1 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 121.1 -0.24 . . . . 0.0 111.094 178.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -75.41 -35.53 60.99 Favored 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 119.771 -0.771 . . . . 0.0 112.465 -178.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -63.92 -45.59 88.57 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.586 175.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.514 HD23 ' HB3' ' A' ' 79' ' ' LEU . 58.3 tp -63.13 -36.67 84.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.157 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 35.0 tp -70.69 -31.05 67.8 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 89.9 m -67.44 -43.04 82.13 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 175.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.55 ' O ' ' HG ' ' B' ' 120' ' ' LEU . 15.0 m -57.98 -46.37 85.28 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.708 0.765 . . . . 0.0 110.408 176.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -62.19 -42.64 99.47 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.745 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 38.0 t -64.97 -41.75 95.18 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.08 179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' B' ' 117' ' ' SER . 3.7 pp -68.65 -33.2 73.59 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-O 120.794 0.331 . . . . 0.0 110.635 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 27.5 t -75.64 -41.7 53.45 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.845 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 18.9 t60 70.78 -67.0 0.27 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.442 1.497 . . . . 0.0 111.211 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 6.4 p -106.35 105.83 16.05 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-O 121.267 0.555 . . . . 0.0 110.19 -179.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -73.81 -176.5 2.45 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.563 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 169.27 -48.02 0.21 Allowed Glycine 0 N--CA 1.432 -1.604 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 98.92 -173.06 26.32 Favored Glycine 0 N--CA 1.435 -1.428 0 N-CA-C 110.333 -1.107 . . . . 0.0 110.333 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 164.96 143.09 3.6 Favored Glycine 0 N--CA 1.432 -1.598 0 C-N-CA 120.182 -1.008 . . . . 0.0 112.387 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 32.3 t -85.45 119.14 25.48 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -88.43 -111.29 1.12 Allowed Glycine 0 N--CA 1.437 -1.241 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.378 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -121.94 -102.43 1.73 Allowed Glycine 0 C--N 1.302 -1.351 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 100.76 84.62 1.81 Allowed Glycine 0 N--CA 1.434 -1.489 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.476 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 22.6 m -83.82 166.07 18.26 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 176.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 169.23 163.59 23.52 Favored Glycine 0 N--CA 1.432 -1.626 0 C-N-CA 120.044 -1.074 . . . . 0.0 112.2 -178.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 129.04 25.96 0.94 Allowed Glycine 0 C--N 1.303 -1.302 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 177.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -106.97 -37.45 2.35 Favored Glycine 0 N--CA 1.422 -2.241 0 C-N-CA 120.868 -0.682 . . . . 0.0 113.081 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 36.6 t -140.09 -67.37 0.43 Allowed 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 -176.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 61.9 mt -105.72 -24.64 12.48 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 121.359 0.599 . . . . 0.0 110.402 -172.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.49 ' HA ' ' SD ' ' B' ' 141' ' ' MET . 1.1 mp0 -66.67 -19.32 65.74 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.95 -176.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 32.7 m -49.91 -47.49 52.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.703 1.601 . . . . 0.0 112.448 -177.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -136.3 74.99 1.52 Allowed 'General case' 0 CA--C 1.487 -1.478 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 174.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.49 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 5.0 ttt -103.32 -29.24 11.37 Favored 'General case' 0 C--O 1.168 -3.204 0 N-CA-C 114.52 1.304 . . . . 0.0 114.52 -168.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' B' ' 142' ' ' GLU . 1.6 mp0 -30.14 -65.61 0.11 Allowed 'General case' 0 N--CA 1.503 2.176 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 -170.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 9.1 p -68.7 -37.97 79.94 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.407 0.622 . . . . 0.0 111.017 -177.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 42.7 mm -64.39 -48.05 86.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.94 -179.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.423 HD11 ' HH ' ' A' ' 65' ' ' TYR . 10.0 tp -65.6 -42.04 92.02 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.443 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.356 -176.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -62.78 -56.35 18.31 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 119.018 -1.073 . . . . 0.0 111.028 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 25.5 t -62.66 -50.93 69.24 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.519 -173.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -80.67 -37.02 31.58 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -174.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.568 HD11 ' SD ' ' B' ' 150' ' ' MET . 2.3 tm? -77.74 -51.92 9.77 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 118.444 -0.788 . . . . 0.0 111.699 -175.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.617 ' HA ' ' CD2' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -172.99 129.99 0.49 Allowed 'General case' 0 C--N 1.366 1.311 0 C-N-CA 118.918 -1.113 . . . . 0.0 113.784 179.732 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -90.72 99.43 12.46 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 107.91 -1.145 . . . . 0.0 107.91 172.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.588 0 CA-C-N 114.197 -1.365 . . . . 0.0 107.401 -176.409 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.323 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.0 t -71.19 110.91 4.5 Favored 'Isoleucine or valine' 0 C--O 1.254 1.294 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.18 113.92 25.17 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 178.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -106.63 117.9 35.25 Favored 'General case' 0 C--N 1.274 -2.707 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -174.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.21 -20.76 44.66 Favored Glycine 0 C--N 1.313 -0.721 0 O-C-N 124.045 0.841 . . . . 0.0 114.533 -174.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -69.58 -8.97 51.96 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 178.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.405 ' CB ' ' HH ' ' A' ' 55' ' ' TYR . 0.6 OUTLIER -65.01 -20.4 66.48 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -179.159 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -80.85 -8.54 59.74 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.265 0.555 . . . . 0.0 110.431 178.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -103.54 5.15 36.52 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 121.464 0.649 . . . . 0.0 111.198 -176.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.613 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 0.9 OUTLIER -122.13 120.43 61.3 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.714 0 N-CA-C 105.132 -2.173 . . . . 0.0 105.132 175.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.482 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.5 m -74.6 149.7 39.96 Favored 'General case' 0 N--CA 1.407 -2.591 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.27 -38.18 85.83 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.07 -30.72 71.29 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.29 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.459 ' O ' HD11 ' A' ' 18' ' ' LEU . 2.7 tm? -75.45 -53.68 8.28 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -177.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.522 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.2 ptm180 -56.44 -44.99 81.01 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 176.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.4 t -69.37 -25.86 64.38 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 121.291 -0.163 . . . . 0.0 110.912 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.448 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 30.6 t60 -70.38 -37.11 74.48 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.495 HD23 HD23 ' A' ' 68' ' ' LEU . 1.7 mp -66.13 -42.72 88.74 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.49 175.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.9 t -55.83 -50.72 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.896 0.878 . . . . 0.0 109.878 174.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -52.51 -47.15 66.82 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.738 176.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.448 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 61.4 mttm -66.98 -40.15 87.35 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.76 178.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.508 ' O ' HG23 ' A' ' 26' ' ' ILE . 64.9 mt -51.8 -51.06 59.2 Favored 'General case' 0 CA--C 1.506 -0.73 0 O-C-N 123.901 0.751 . . . . 0.0 110.252 175.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.451 HG12 ' HE1' ' A' ' 40' ' ' MET . 78.1 t -54.55 -53.14 33.87 Favored 'Isoleucine or valine' 0 C--O 1.186 -2.283 0 O-C-N 124.164 0.915 . . . . 0.0 110.258 176.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.74 -36.41 62.29 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -176.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.79 -45.71 15.22 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 177.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.508 HG23 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.77 -26.37 16.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.832 0.825 . . . . 0.0 110.49 -174.698 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.501 ' CD2' HG22 ' A' ' 26' ' ' ILE . 50.6 m-85 -130.69 93.52 31.51 Favored Pre-proline 0 C--N 1.285 -2.23 0 C-N-CA 124.187 0.995 . . . . 0.0 109.877 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.428 ' CG ' ' HA ' ' B' ' 118' ' ' ASP . 35.9 Cg_endo -65.88 109.01 1.39 Allowed 'Trans proline' 0 C--O 1.249 1.027 0 C-N-CA 121.7 1.6 . . . . 0.0 109.904 176.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.4 t -76.07 140.14 69.71 Favored Pre-proline 0 N--CA 1.43 -1.426 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.196 -174.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -72.21 -36.2 5.89 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.336 2.024 . . . . 0.0 111.101 176.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -146.97 146.3 25.48 Favored Pre-proline 0 C--N 1.313 -1.001 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 -176.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -55.39 -24.11 41.59 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 122.413 2.076 . . . . 0.0 114.132 175.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.47 -11.49 59.85 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.082 -1.011 . . . . 0.0 111.856 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.0 -9.15 58.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.665 0.745 . . . . 0.0 109.557 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.466 ' O ' ' HG2' ' A' ' 40' ' ' MET . 18.1 mt -90.15 -5.55 56.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.085 -0.962 . . . . 0.0 110.39 -178.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -133.81 33.16 3.47 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.631 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 32.5 t70 -112.13 176.59 4.96 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 113.76 -1.564 . . . . 0.0 110.65 -173.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.631 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.28 -25.59 62.51 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-O 121.196 0.522 . . . . 0.0 110.635 176.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.54 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 5.2 tpm_? -71.15 -30.83 66.94 Favored 'General case' 0 C--O 1.252 1.219 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 176.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.802 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.5 tpp -58.25 -39.91 80.39 Favored 'General case' 0 C--O 1.197 -1.66 0 CA-C-N 114.483 -1.235 . . . . 0.0 112.683 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 10.9 pt-20 -59.05 -30.38 68.01 Favored 'General case' 0 C--O 1.205 -1.281 0 C-N-CA 119.521 -0.871 . . . . 0.0 110.919 -177.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -74.77 -46.18 38.77 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.287 0.565 . . . . 0.0 109.902 176.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.2 mt -60.2 -51.14 70.86 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.715 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.802 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -71.88 -27.88 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.646 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.376 -178.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -58.49 -46.68 86.19 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.511 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 7.5 t80 -59.76 -47.1 87.02 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.4 174.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.49 97.83 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 120.369 -0.533 . . . . 0.0 111.306 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -65.14 -45.81 83.49 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.206 0.602 . . . . 0.0 111.34 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.511 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 56.5 pttt -63.71 -38.04 89.63 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-O 121.726 0.774 . . . . 0.0 110.321 -178.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.486 HG21 ' CE1' ' A' ' 46' ' ' TYR . 39.9 t -73.82 -42.84 53.9 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.225 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.134 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.428 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 15.0 tm-20 -58.6 -44.4 89.88 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.55 -43.51 97.55 Favored Glycine 0 CA--C 1.501 -0.783 0 O-C-N 123.626 0.579 . . . . 0.0 111.949 177.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -55.48 -54.36 44.79 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 123.025 0.53 . . . . 0.0 111.718 177.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.469 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -70.76 -29.77 66.09 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.405 ' HH ' ' CB ' ' A' ' 7' ' ' HIS . 52.5 t80 -64.64 -49.84 69.43 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 177.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -76.33 -14.23 60.11 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.22 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.1 t -86.77 -17.72 32.84 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.848 0.356 . . . . 0.0 110.106 176.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.43 171.81 8.16 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-O 121.225 0.536 . . . . 0.0 112.045 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -124.02 14.6 9.18 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.723 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 82.5 p -167.9 156.59 9.29 Favored 'General case' 0 CA--C 1.486 -1.505 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 175.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.613 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -67.36 -31.32 71.49 Favored 'General case' 0 C--O 1.189 -2.128 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.625 175.03 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -58.78 -47.88 83.18 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 123.725 0.641 . . . . 0.0 110.499 178.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -65.96 -45.12 82.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.57 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.11 -46.46 77.51 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.856 -176.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.441 ' HH ' HG22 ' B' ' 144' ' ' ILE . 4.2 t80 -60.62 -44.29 96.5 Favored 'General case' 0 C--O 1.204 -1.323 0 C-N-CA 123.831 0.852 . . . . 0.0 109.283 177.238 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.443 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 7.4 t60 -58.88 -57.32 13.58 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 123.261 0.624 . . . . 0.0 110.925 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.2 pp -68.03 -33.21 74.16 Favored 'General case' 0 C--O 1.258 1.537 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -173.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.495 HD23 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -72.34 -37.78 68.78 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 179.573 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.526 ' HB3' ' HA ' ' B' ' 149' ' ' LEU . . . -60.39 -40.11 89.72 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.552 176.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 55.7 mm-40 -60.78 -46.11 91.75 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.01 178.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -42.5 75.3 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 118.769 -1.172 . . . . 0.0 111.23 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.452 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.5 tt -63.13 -42.26 95.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.751 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -57.19 -52.97 63.18 Favored 'General case' 0 C--O 1.274 2.366 0 C-N-CA 125.054 1.342 . . . . 0.0 110.379 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.456 ' HZ1' ' HB3' ' A' ' 74' ' ' LYS . 0.5 OUTLIER -65.6 -32.06 73.44 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.571 -178.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -68.1 -37.12 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 123.007 0.523 . . . . 0.0 111.11 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.552 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 34.9 mt-30 -65.59 -45.67 82.3 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 121.189 0.519 . . . . 0.0 110.751 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.516 ' HZ2' ' HB3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -70.32 -27.88 64.72 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 118.472 -1.291 . . . . 0.0 113.034 175.605 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -63.44 -48.42 77.81 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 175.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.7 pp -62.9 -40.46 97.64 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.06 -178.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.425 ' N ' HD11 ' A' ' 79' ' ' LEU . 0.7 OUTLIER -60.39 -53.33 58.9 Favored 'General case' 0 N--CA 1.412 -2.344 0 O-C-N 123.956 0.785 . . . . 0.0 110.467 -179.61 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -72.35 -33.17 67.09 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 118.982 -1.087 . . . . 0.0 112.54 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.415 ' HE3' ' CG ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -67.21 -34.14 76.87 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.396 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -77.98 -40.54 38.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.713 178.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 -87.41 -57.94 2.77 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -171.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.432 ' O ' ' HB3' ' A' ' 86' ' ' ARG . 66.4 m -155.28 98.9 2.03 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.448 ' HG3' ' HG ' ' A' ' 87' ' ' LEU . 4.5 ptp180 176.15 -31.66 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.071 0 C-N-CA 126.639 1.975 . . . . 0.0 109.313 170.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.448 ' HG ' ' HG3' ' A' ' 86' ' ' ARG . 36.2 mt . . . . . 0 C--O 1.243 0.738 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.448 -177.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.679 0 CA-C-O 121.881 0.712 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 20.3 m -132.64 90.71 2.81 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-O 121.116 0.484 . . . . 0.0 110.273 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 25.2 mmt -120.85 -30.42 4.43 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.886 177.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 19.8 m -85.09 -43.88 13.5 Favored 'General case' 0 N--CA 1.435 -1.224 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.777 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -97.65 89.3 4.6 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-O 122.323 1.058 . . . . 0.0 108.272 174.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . 0.49 ' HA ' ' CG ' ' B' ' 109' ' ' GLN . 84.8 m-85 72.62 165.92 0.3 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 113.557 -1.656 . . . . 0.0 111.25 -172.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 95.44 -83.73 0.89 Allowed Glycine 0 C--N 1.304 -1.226 0 N-CA-C 110.657 -0.977 . . . . 0.0 110.657 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . 0.402 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 14.2 m120 -96.37 62.92 2.11 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 177.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . 0.49 ' CG ' ' HA ' ' B' ' 106' ' ' TYR . 23.9 mm-40 -82.4 -35.7 27.44 Favored 'General case' 0 CA--C 1.481 -1.687 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.374 -178.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 19.3 p -61.08 -36.53 79.89 Favored 'General case' 0 C--O 1.2 -1.536 0 O-C-N 123.969 0.793 . . . . 0.0 110.269 178.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 61.1 tp -58.73 -43.83 90.29 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 122.951 0.5 . . . . 0.0 110.733 176.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 47.1 mm-40 -66.54 -50.63 62.54 Favored 'General case' 0 C--O 1.252 1.22 0 CA-C-O 121.417 0.627 . . . . 0.0 109.358 -177.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -60.89 -48.18 83.01 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.723 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.521 ' HA ' ' OG ' ' B' ' 117' ' ' SER . 36.9 tp -69.65 -20.51 63.58 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.908 -176.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.0 tp -74.89 -44.36 49.27 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 173.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.474 ' O ' ' HB3' ' B' ' 119' ' ' SER . 42.2 m -68.9 -36.68 78.33 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 114.506 -1.224 . . . . 0.0 111.062 -179.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.521 ' OG ' ' HA ' ' B' ' 114' ' ' LEU . 68.2 p -75.95 -34.98 59.85 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.011 0.434 . . . . 0.0 110.108 178.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 20.6 t70 -59.01 -36.58 75.18 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.597 0.713 . . . . 0.0 109.409 175.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 119' ' ' SER . . . . . 0.474 ' HB3' ' O ' ' B' ' 116' ' ' THR . 38.1 t -57.83 -11.04 1.97 Allowed 'General case' 0 CA--C 1.561 1.375 0 CA-C-N 114.009 -1.451 . . . . 0.0 112.581 178.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 67.4 tp -62.74 -62.42 1.75 Allowed 'General case' 0 C--N 1.347 0.477 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 174.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 33.5 t -77.26 -28.09 53.4 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 29.2 t60 84.96 -57.7 0.09 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 126.644 1.977 . . . . 0.0 109.674 -177.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 19.0 p -169.81 75.87 0.09 Allowed 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 176.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -176.64 145.22 0.53 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.715 0.406 . . . . 0.0 110.094 174.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 88.42 -123.52 6.79 Favored Glycine 0 N--CA 1.429 -1.814 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -179.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 126.26 -125.89 5.6 Favored Glycine 0 N--CA 1.427 -1.943 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.676 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -101.55 -154.15 26.07 Favored Glycine 0 N--CA 1.427 -1.924 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.12 -179.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 33.0 t -156.21 137.72 14.04 Favored 'General case' 0 N--CA 1.429 -1.524 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -90.45 -169.5 43.09 Favored Glycine 0 N--CA 1.432 -1.579 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.412 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 78.9 178.9 51.2 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.245 177.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -155.54 153.19 24.58 Favored Glycine 0 N--CA 1.438 -1.231 0 N-CA-C 108.624 -1.791 . . . . 0.0 108.624 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 46.9 m -141.33 138.01 32.8 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 117.987 0.894 . . . . 0.0 110.534 -177.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 142.72 174.44 15.12 Favored Glycine 0 N--CA 1.43 -1.701 0 C-N-CA 120.922 -0.656 . . . . 0.0 113.044 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -152.33 135.67 5.07 Favored Glycine 0 N--CA 1.438 -1.19 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 176.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 142.68 -129.08 3.68 Favored Glycine 0 N--CA 1.435 -1.401 0 C-N-CA 120.204 -0.998 . . . . 0.0 112.512 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 2.7 p -62.42 -70.82 0.18 Allowed 'General case' 0 CA--C 1.556 1.195 0 N-CA-C 115.456 1.65 . . . . 0.0 115.456 -174.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 65.7 mt -106.26 -27.73 10.85 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 122.069 0.938 . . . . 0.0 109.078 -177.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -73.45 -12.0 60.65 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.146 -1.388 . . . . 0.0 114.051 -175.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 6.9 p -55.44 -60.46 3.39 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -178.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -120.99 85.11 2.34 Favored 'General case' 0 CA--C 1.477 -1.841 0 N-CA-C 104.325 -2.472 . . . . 0.0 104.325 173.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.483 ' O ' HG12 ' B' ' 145' ' ' ILE . 19.4 ttt -93.45 -38.79 11.25 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 114.189 -1.369 . . . . 0.0 112.66 -164.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 41.3 mt-10 -55.61 -42.25 74.62 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -174.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.4 p -59.26 -51.65 69.06 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.36 0.6 . . . . 0.0 110.722 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . 0.441 HG22 ' HH ' ' A' ' 65' ' ' TYR . 41.1 mt -67.3 -47.54 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.686 -177.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 141' ' ' MET . 40.4 pt -66.32 -31.19 52.5 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.141 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 91.2 mtt180 -68.97 -53.15 22.3 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 118.423 -1.311 . . . . 0.0 108.883 177.014 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 47.6 t -60.67 -54.96 38.92 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.403 -177.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -82.4 -41.49 19.85 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 -178.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.526 ' HA ' ' HB3' ' A' ' 69' ' ' ALA . 9.4 tt -97.59 -34.29 11.02 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -166.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 22.7 ptt? -169.36 127.82 0.98 Allowed 'General case' 0 C--O 1.242 0.671 0 CA-C-O 123.24 1.495 . . . . 0.0 114.203 -176.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -107.8 -59.82 1.79 Allowed 'General case' 0 C--N 1.271 -2.841 0 CA-C-N 112.539 -2.118 . . . . 0.0 108.325 -177.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.66 0 N-CA-C 101.366 -3.568 . . . . 0.0 101.366 -179.843 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.094 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.7 m -89.84 104.54 15.23 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 122.452 1.12 . . . . 0.0 113.019 -178.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.25 93.76 4.68 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.544 177.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 9.9 ptpt -143.41 103.62 4.13 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.906 -1.497 . . . . 0.0 109.999 -174.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.57 -20.16 1.55 Allowed Glycine 0 N--CA 1.484 1.85 0 N-CA-C 117.121 1.608 . . . . 0.0 117.121 -170.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.435 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 67.2 p-90 -67.84 -16.51 64.13 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 117.462 0.631 . . . . 0.0 111.798 179.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -67.72 -9.91 47.86 Favored 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -89.47 -8.05 53.72 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.417 0.627 . . . . 0.0 109.663 176.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -100.04 3.08 43.92 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.634 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.0 p -135.27 113.82 15.97 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.997 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 -177.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 m -96.28 163.75 12.95 Favored 'General case' 0 N--CA 1.419 -2.01 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -176.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.16 -36.43 40.95 Favored 'General case' 0 C--O 1.213 -0.827 0 C-N-CA 124.325 1.05 . . . . 0.0 111.498 179.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -55.42 -44.81 76.59 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 123.257 0.623 . . . . 0.0 111.807 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.476 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.0 tm? -70.23 -51.14 33.03 Favored 'General case' 0 CA--C 1.492 -1.281 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -175.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.547 ' O ' HG21 ' A' ' 19' ' ' VAL . 4.6 ptm180 -65.52 -40.99 93.59 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 114.505 -1.225 . . . . 0.0 113.091 -175.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.2 t -68.18 -28.33 67.18 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -66.5 -43.0 86.53 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.49 HD23 HD22 ' A' ' 68' ' ' LEU . 5.1 mp -67.38 -40.61 85.7 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.033 177.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.547 HG21 ' O ' ' A' ' 15' ' ' ARG . 65.2 t -57.6 -49.21 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.7 0.8 . . . . 0.0 110.095 175.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -54.49 -45.1 73.17 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.309 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.4 mttm -68.55 -38.32 80.68 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.315 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.506 ' O ' HG21 ' A' ' 26' ' ' ILE . 65.8 mt -54.07 -46.58 72.05 Favored 'General case' 0 C--O 1.214 -0.787 0 O-C-N 123.661 0.601 . . . . 0.0 109.589 174.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.425 HG13 ' HE3' ' A' ' 40' ' ' MET . 46.8 t -55.28 -53.43 35.29 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.559 0 O-C-N 124.003 0.815 . . . . 0.0 110.833 174.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -57.32 -30.69 64.99 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.465 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -82.77 -46.91 12.54 Favored 'General case' 0 C--O 1.203 -1.372 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 174.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.506 HG21 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.32 -26.57 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 121.799 0.809 . . . . 0.0 110.068 -174.819 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -131.53 91.89 33.11 Favored Pre-proline 0 N--CA 1.405 -2.721 0 C-N-CA 124.438 1.095 . . . . 0.0 108.594 176.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -63.64 93.3 0.17 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.725 1.617 . . . . 0.0 109.202 176.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.8 t -65.82 130.05 94.41 Favored Pre-proline 0 N--CA 1.415 -2.18 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.567 -172.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.474 ' HG2' ' OD1' ' A' ' 31' ' ' ASP . 41.8 Cg_endo -73.64 -31.63 8.46 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.588 2.192 . . . . 0.0 111.085 178.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.474 ' OD1' ' HG2' ' A' ' 30' ' ' PRO . 6.3 p-10 -144.18 155.4 58.24 Favored Pre-proline 0 N--CA 1.427 -1.622 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.429 -175.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.453 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 72.5 Cg_endo -75.66 -5.23 16.26 Favored 'Trans proline' 0 N--CA 1.45 -1.068 0 C-N-CA 121.77 1.647 . . . . 0.0 113.351 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -88.54 -24.68 22.84 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.542 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.93 -21.09 63.07 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 122.038 0.923 . . . . 0.0 109.831 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.453 ' CD1' ' HA ' ' A' ' 32' ' ' PRO . 45.2 mt -80.05 -8.44 59.37 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.24 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -134.2 21.93 3.76 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.215 0.531 . . . . 0.0 109.927 178.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.404 ' O ' ' HB3' ' A' ' 40' ' ' MET . 20.5 t70 -90.11 178.02 6.29 Favored 'General case' 0 N--CA 1.422 -1.862 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.802 ' HD2' ' N ' ' A' ' 39' ' ' ARG . 2.3 ppt_? -63.75 -28.9 70.2 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.802 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 4.5 tpm_? -70.18 -30.19 67.25 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.032 -175.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.711 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 6.7 tpp -57.72 -32.17 67.15 Favored 'General case' 0 C--O 1.201 -1.452 0 CA-C-N 114.231 -1.35 . . . . 0.0 112.086 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.592 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -61.42 -29.83 70.18 Favored 'General case' 0 C--O 1.18 -2.594 0 C-N-CA 118.111 -1.436 . . . . 0.0 110.918 -179.445 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -75.48 -46.66 31.14 Favored 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 124.024 0.828 . . . . 0.0 109.088 176.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.584 HD11 ' O ' ' A' ' 39' ' ' ARG . 5.2 mp -51.63 -56.94 10.72 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 114.299 -1.319 . . . . 0.0 109.894 179.275 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.711 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -73.29 -28.2 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.59 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.517 -177.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.592 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -61.53 -43.24 99.22 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.525 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.9 t80 -65.81 -47.08 76.26 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.61 174.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.44 -40.91 88.32 Favored 'General case' 0 C--O 1.2 -1.51 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.829 -176.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 91.4 mttt -67.7 -43.07 80.94 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.612 0.765 . . . . 0.0 111.997 178.251 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.525 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 57.0 pttt -67.04 -40.25 87.12 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.399 0.619 . . . . 0.0 109.708 -178.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.438 HG22 ' CE2' ' A' ' 46' ' ' TYR . 45.7 t -71.53 -47.26 59.23 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.668 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.7 tm-20 -57.73 -45.65 85.52 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.189 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.91 -44.39 94.45 Favored Glycine 0 N--CA 1.436 -1.349 0 O-C-N 124.236 0.96 . . . . 0.0 111.768 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -58.72 -54.19 49.86 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.48 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -65.26 -35.21 80.31 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 178.768 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -62.91 -50.88 69.1 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.644 0.735 . . . . 0.0 109.34 177.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.78 -21.75 61.68 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.163 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.7 t -85.28 -42.8 14.3 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -178.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.05 163.52 14.63 Favored 'General case' 0 C--O 1.244 0.797 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -109.05 2.82 21.46 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.583 -178.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.7 m -161.44 154.29 20.69 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 176.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.58 -34.53 74.28 Favored 'General case' 0 C--O 1.196 -1.757 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.184 -178.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -65.12 -35.83 82.36 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -66.82 -47.84 70.78 Favored 'General case' 0 N--CA 1.455 -0.175 0 O-C-N 123.487 0.492 . . . . 0.0 110.564 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -45.1 89.94 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.252 -177.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -60.65 -46.01 91.92 Favored 'General case' 0 C--O 1.19 -2.063 0 O-C-N 123.978 0.799 . . . . 0.0 109.719 176.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.477 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 28.7 t-80 -60.05 -55.05 38.7 Favored 'General case' 0 C--O 1.208 -1.104 0 O-C-N 123.194 0.309 . . . . 0.0 111.581 -178.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.1 pp -65.74 -32.55 74.16 Favored 'General case' 0 C--O 1.262 1.746 0 CA-C-O 120.965 0.412 . . . . 0.0 111.47 -175.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.49 HD22 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -75.09 -35.83 61.75 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.362 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.477 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -63.11 -34.84 78.47 Favored 'General case' 0 C--O 1.203 -1.347 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.736 176.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 17.2 mt-10 -69.43 -42.53 74.86 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.467 178.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.9 -38.82 83.47 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.393 -0.923 . . . . 0.0 110.891 179.231 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.572 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 5.9 tt -66.2 -48.37 81.48 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.853 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.548 177.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.457 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 8.3 t80 -51.71 -51.39 56.4 Favored 'General case' 0 C--O 1.269 2.116 0 C-N-CA 124.949 1.3 . . . . 0.0 111.837 178.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.523 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.8 ptpt -65.03 -38.8 92.06 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.884 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.42 -37.06 79.03 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.654 0 O-C-N 123.557 0.536 . . . . 0.0 111.124 178.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.651 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.2 mm-40 -59.65 -55.38 35.17 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 122.085 0.945 . . . . 0.0 109.454 178.479 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 1.2 ptpm? -70.19 -27.66 64.68 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.572 178.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.523 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 6.3 tp10 -63.67 -45.84 88.28 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 176.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.651 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.7 pp -64.79 -44.83 88.7 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.874 -177.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.459 ' N ' HD13 ' A' ' 79' ' ' LEU . 7.1 pt-20 -68.67 -44.63 73.65 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 119.364 -0.934 . . . . 0.0 112.65 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.6 -40.06 95.73 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.421 -0.511 . . . . 0.0 110.813 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.66 -29.83 62.56 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.403 -178.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -76.82 -42.66 39.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.035 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -90.12 -59.14 2.27 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.349 -0.54 . . . . 0.0 112.396 -173.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.8 t -175.71 105.23 0.08 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 120.955 0.407 . . . . 0.0 110.443 -174.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -121.76 -24.47 5.26 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 173.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 C--O 1.244 0.785 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 176.773 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.673 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 7.8 p -61.12 -41.53 96.88 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.537 0.684 . . . . 0.0 111.029 -178.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 22.0 ptm -71.5 -6.43 40.45 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.36 -0.837 . . . . 0.0 112.073 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' SER . . . . . 0.415 ' HA ' ' NE2' ' B' ' 112' ' ' GLN . 5.4 m -105.32 -53.51 2.64 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 36.2 m80 -87.57 -12.81 44.63 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.727 -173.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -137.48 20.75 2.93 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 122.212 1.005 . . . . 0.0 108.828 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -139.45 74.2 0.39 Allowed Glycine 0 N--CA 1.436 -1.345 0 N-CA-C 110.093 -1.203 . . . . 0.0 110.093 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 63.65 76.9 0.34 Allowed 'General case' 0 C--O 1.245 0.841 0 C-N-CA 124.273 1.029 . . . . 0.0 109.266 -174.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -62.81 -50.93 69.05 Favored 'General case' 0 CA--C 1.505 -0.78 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.003 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 5.2 t -68.11 -35.23 77.8 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -168.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 58.8 tp -69.51 -41.67 75.72 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.269 0.941 . . . . 0.0 110.763 -178.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.415 ' NE2' ' HA ' ' B' ' 104' ' ' SER . 21.4 mt-30 -75.52 -34.02 60.77 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.539 -177.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -64.66 -46.83 80.81 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.86 0.838 . . . . 0.0 109.266 174.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.475 HD23 ' HB3' ' A' ' 79' ' ' LEU . 47.7 tp -65.55 -28.47 69.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.128 179.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 46.4 tp -69.58 -37.72 77.09 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 18.2 m -63.56 -41.35 98.41 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 14.3 m -63.94 -46.67 83.69 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.417 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -61.27 -29.58 69.94 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 125.117 1.367 . . . . 0.0 111.135 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 8.9 t -67.53 -28.82 68.13 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.107 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 9.9 tt -83.17 -24.01 32.66 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 123.096 0.558 . . . . 0.0 110.209 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 19.6 m -62.16 -36.32 81.48 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.821 -179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 68.56 -63.07 0.36 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.054 0.942 . . . . 0.0 111.134 -178.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 14.5 m -98.02 172.08 7.85 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.28 99.43 1.18 Allowed 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -90.06 175.2 41.29 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.195 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 172.72 -161.06 32.33 Favored Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -170.25 156.99 28.04 Favored Glycine 0 N--CA 1.434 -1.443 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 50.0 m -139.21 173.79 11.18 Favored 'General case' 0 C--N 1.29 -1.992 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 179.21 179.72 48.76 Favored Glycine 0 N--CA 1.429 -1.785 0 C-N-CA 120.14 -1.029 . . . . 0.0 111.978 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 104.1 135.85 8.66 Favored Glycine 0 N--CA 1.431 -1.691 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -108.96 -140.29 8.97 Favored Glycine 0 N--CA 1.421 -2.313 0 N-CA-C 109.079 -1.609 . . . . 0.0 109.079 176.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.0 t -140.03 75.98 1.54 Allowed 'General case' 0 N--CA 1.418 -2.039 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 173.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -165.27 51.86 0.27 Allowed Glycine 0 N--CA 1.429 -1.783 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 176.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -61.02 87.99 0.03 OUTLIER Glycine 0 C--O 1.241 0.567 0 O-C-N 124.644 0.85 . . . . 0.0 113.872 -176.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 179.92 131.13 1.59 Allowed Glycine 0 N--CA 1.416 -2.648 0 N-CA-C 108.212 -1.955 . . . . 0.0 108.212 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 34.2 m 71.1 108.79 0.06 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.629 0.772 . . . . 0.0 110.48 -176.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.436 ' HA ' ' CG ' ' B' ' 141' ' ' MET . 1.8 pt? -40.67 -49.44 3.04 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.215 1.806 . . . . 0.0 114.965 -174.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -82.76 -12.83 57.23 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 46.4 t -83.81 -61.49 1.81 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -173.12 130.76 0.48 Allowed 'General case' 0 CA--C 1.492 -1.259 0 C-N-CA 123.834 0.854 . . . . 0.0 108.886 176.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.471 ' HB2' ' HB ' ' B' ' 145' ' ' ILE . 64.0 mtm -103.36 -8.4 20.28 Favored 'General case' 0 C--N 1.28 -2.448 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -177.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 29.4 -86.54 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 127.684 2.394 . . . . 0.0 114.432 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.53 -46.95 62.64 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.966 -172.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 47.3 mm -64.42 -47.97 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-N 114.161 -1.381 . . . . 0.0 109.167 -177.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.471 ' HB ' ' HB2' ' B' ' 141' ' ' MET . 15.6 tt -70.01 -31.57 48.26 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.403 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.616 -176.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 27.6 ttm-85 -64.73 -60.6 2.92 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 19.3 p -66.78 -44.04 82.37 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -174.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -80.57 -38.83 28.79 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.461 ' HB3' ' O ' ' B' ' 145' ' ' ILE 0.267 9.1 tt -91.17 -42.63 10.34 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -173.431 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -159.95 123.2 3.55 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 117.818 -1.553 . . . . 0.0 114.116 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -119.96 118.46 30.75 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 114.369 -1.287 . . . . 0.0 109.326 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.288 -2.079 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 178.074 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.483 -1.959 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 93.4 t 69.18 121.32 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.795 0 CA-C-O 121.889 0.852 . . . . 0.0 110.52 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.442 ' HD2' ' HA ' ' A' ' 3' ' ' ARG . 1.5 tpt180 -83.58 111.48 19.14 Favored 'General case' 0 N--CA 1.408 -2.57 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.096 -172.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -115.58 108.62 16.66 Favored 'General case' 0 N--CA 1.42 -1.975 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 178.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.445 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -67.03 -3.92 25.56 Favored Glycine 0 C--N 1.31 -0.889 0 CA-C-N 115.838 -0.619 . . . . 0.0 114.263 -174.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 61.1 p-90 -78.76 -11.84 60.0 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 122.275 -0.544 . . . . 0.0 111.108 177.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -59.07 -26.56 64.73 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-O 121.267 0.556 . . . . 0.0 111.233 -178.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 12.9 pt-20 -81.89 -4.11 55.77 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -176.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -104.52 2.78 31.24 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 120.973 0.416 . . . . 0.0 111.555 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.61 ' CG2' ' HB3' ' A' ' 61' ' ' ARG . 1.5 t -110.5 110.54 32.55 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.459 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.507 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER -68.9 151.55 46.42 Favored 'General case' 0 N--CA 1.412 -2.373 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -179.15 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -55.03 -41.65 71.62 Favored 'General case' 0 N--CA 1.426 -1.627 0 O-C-N 124.672 1.232 . . . . 0.0 108.796 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 10.9 m-20 -67.45 -30.52 70.28 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-O 118.866 -0.587 . . . . 0.0 112.534 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.519 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.4 tm? -73.68 -54.65 7.62 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 11' ' ' THR . 1.6 ptm180 -55.14 -48.2 74.02 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 177.027 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 m -72.61 -21.13 61.17 Favored 'General case' 0 N--CA 1.426 -1.664 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.481 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 10.5 t60 -67.89 -42.43 81.22 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 174.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.519 HD11 ' O ' ' A' ' 14' ' ' LEU . 3.9 mp -69.84 -40.08 76.05 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.794 178.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.2 t -55.8 -49.72 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 C-N-CA 123.559 0.744 . . . . 0.0 109.942 172.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -53.15 -50.38 64.66 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.264 1.026 . . . . 0.0 110.122 178.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -66.73 -38.14 86.08 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.046 179.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.505 ' O ' HG23 ' A' ' 26' ' ' ILE . 3.2 mt -51.02 -50.79 57.87 Favored 'General case' 0 CA--C 1.495 -1.152 0 O-C-N 123.924 0.765 . . . . 0.0 109.61 174.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.441 HG13 ' HE1' ' A' ' 40' ' ' MET . 57.8 t -55.56 -52.78 43.56 Favored 'Isoleucine or valine' 0 C--O 1.172 -2.999 0 O-C-N 124.336 1.023 . . . . 0.0 109.771 175.155 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -54.09 -33.29 57.21 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -175.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.01 -46.23 14.24 Favored 'General case' 0 C--O 1.207 -1.175 0 CA-C-O 121.505 0.669 . . . . 0.0 111.597 175.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.567 HG22 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -78.55 -23.69 13.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 CA-C-O 122.065 0.936 . . . . 0.0 110.84 -174.082 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.567 ' CD2' HG22 ' A' ' 26' ' ' ILE . 66.1 m-85 -135.31 95.26 14.86 Favored Pre-proline 0 C--N 1.279 -2.47 0 C-N-CA 125.057 1.343 . . . . 0.0 107.491 178.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -60.53 95.29 0.11 Allowed 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.287 1.992 . . . . 0.0 112.47 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.0 t -75.27 124.62 89.29 Favored Pre-proline 0 N--CA 1.424 -1.74 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.058 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.39 -29.36 13.85 Favored 'Trans proline' 0 C--O 1.245 0.869 0 C-N-CA 122.402 2.068 . . . . 0.0 111.752 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -141.54 151.72 61.39 Favored Pre-proline 0 CA--C 1.486 -1.496 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -176.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.411 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 38.1 Cg_endo -71.67 -7.35 21.0 Favored 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 121.587 1.525 . . . . 0.0 111.611 175.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.9 -12.9 43.39 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-O 121.318 0.58 . . . . 0.0 110.69 177.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.53 -6.09 54.48 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 122.159 0.98 . . . . 0.0 108.722 175.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.568 ' O ' ' HG2' ' A' ' 40' ' ' MET . 27.6 mt -91.75 6.53 45.59 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.797 -179.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -133.07 21.91 4.12 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.593 ' OD1' ' HD3' ' A' ' 38' ' ' ARG . 13.9 t70 -85.16 170.26 13.06 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.695 -1.593 . . . . 0.0 108.449 -178.121 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.593 ' HD3' ' OD1' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.63 -24.74 61.93 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.939 0.876 . . . . 0.0 110.567 178.747 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.602 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 40.3 ttp180 -75.02 -21.2 59.23 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.818 -1.083 . . . . 0.0 109.109 178.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.756 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.2 tpp -60.67 -34.26 74.05 Favored 'General case' 0 C--O 1.207 -1.155 0 CA-C-N 115.124 -0.943 . . . . 0.0 112.413 -179.189 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.504 ' O ' ' HB1' ' A' ' 45' ' ' ALA . 0.5 OUTLIER -62.36 -31.24 71.86 Favored 'General case' 0 C--O 1.197 -1.689 0 C-N-CA 117.748 -1.581 . . . . 0.0 110.711 -178.87 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -74.31 -46.49 40.7 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 121.393 0.616 . . . . 0.0 109.712 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.3 mt -59.78 -49.63 76.97 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.578 -179.052 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.756 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.6 p -73.3 -27.68 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.577 -178.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.504 ' HB1' ' O ' ' A' ' 41' ' ' GLU . . . -59.31 -47.06 86.83 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 177.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.52 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 16.6 t80 -62.91 -45.69 91.34 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.068 174.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.66 94.12 Favored 'General case' 0 C--O 1.203 -1.352 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.216 -177.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -62.85 -44.79 95.19 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 123.29 0.636 . . . . 0.0 111.327 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.52 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 53.9 pttt -66.64 -36.49 82.7 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.645 0.736 . . . . 0.0 110.702 -177.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.498 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 69.4 t -75.23 -42.68 44.18 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.668 178.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.77 -43.3 90.33 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.23 -43.44 98.46 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.502 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.401 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 21.3 t70 -53.93 -51.97 62.08 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.257 0.623 . . . . 0.0 111.373 178.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.44 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -74.28 -27.6 60.81 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 179.66 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -63.86 -49.86 71.08 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 176.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -73.18 -22.63 60.44 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.979 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.3 t -81.37 -13.6 58.14 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.136 178.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.26 169.58 9.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.532 0.682 . . . . 0.0 112.487 -178.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -119.13 6.38 11.27 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.468 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.9 m -164.94 147.37 8.2 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.61 ' HB3' ' CG2' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -55.87 -40.39 72.87 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 175.343 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -56.17 -46.13 79.44 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.229 0.537 . . . . 0.0 110.139 178.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.65 -46.42 82.59 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.153 178.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -44.06 92.95 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 123.366 0.416 . . . . 0.0 109.994 -177.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -59.83 -47.58 85.15 Favored 'General case' 0 C--O 1.201 -1.45 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.631 175.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -62.31 -48.42 79.95 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -177.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.401 HD13 ' CB ' ' A' ' 54' ' ' MET . 3.9 pp -71.97 -30.69 65.53 Favored 'General case' 0 C--O 1.258 1.507 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.273 -175.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.461 HD22 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -75.77 -33.6 60.2 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.507 ' HB3' ' HA ' ' B' ' 149' ' ' LEU . . . -62.07 -40.12 94.72 Favored 'General case' 0 C--O 1.198 -1.607 0 CA-C-N 115.03 -0.986 . . . . 0.0 108.781 176.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.87 -46.46 87.76 Favored 'General case' 0 C--O 1.259 1.58 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.932 177.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.77 -40.82 88.35 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.168 179.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.525 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 7.8 tt -67.08 -44.76 87.93 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.228 -178.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -52.64 -49.5 65.03 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 125.869 1.668 . . . . 0.0 111.215 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 16.6 ptpt -69.18 -33.26 73.1 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.442 -179.324 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.45 HD11 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -66.28 -39.28 83.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 116.772 -0.194 . . . . 0.0 110.707 175.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.568 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 22.5 mm-40 -58.62 -48.54 80.66 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.306 0.575 . . . . 0.0 109.491 178.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.715 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS 0.252 0.0 OUTLIER -69.5 -33.35 72.72 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 175.917 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -59.37 -45.92 90.1 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 176.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.4 pp -67.36 -39.71 85.73 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.459 -179.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 14.6 pt-20 -63.74 -45.16 91.16 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.04 0.382 . . . . 0.0 110.457 -178.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.7 pt-20 -76.01 -37.8 58.02 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -33.34 72.92 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.034 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 28.9 tpt180 -73.61 -38.35 65.11 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.572 ' O ' ' HB2' ' A' ' 85' ' ' SER . 6.9 tmm_? -72.31 -18.02 61.81 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.585 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.572 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 70.2 m 92.75 116.9 0.02 OUTLIER 'General case' 0 C--N 1.349 0.546 0 C-N-CA 126.607 1.963 . . . . 0.0 109.288 -172.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -119.48 -11.75 9.44 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 C--N 1.302 -1.464 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.185 -177.595 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.045 0 N-CA-C 111.725 -0.55 . . . . 0.0 111.725 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 27.1 m -74.85 -33.39 62.12 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.662 0.268 . . . . 0.0 111.715 -178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 47.3 ttm -89.38 -27.42 20.46 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 43.4 t 76.27 134.4 0.06 Allowed 'General case' 0 C--O 1.24 0.595 0 C-N-CA 125.171 1.389 . . . . 0.0 109.992 -175.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 45.3 m80 -63.14 -41.22 99.25 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 47.5 t80 72.29 -12.96 0.66 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.571 1.548 . . . . 0.0 114.315 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -84.54 -75.16 1.22 Allowed Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.036 -1.078 . . . . 0.0 110.742 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -87.14 26.35 1.2 Allowed 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 123.5 0.72 . . . . 0.0 111.261 -177.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.13 -26.34 60.36 Favored 'General case' 0 C--O 1.213 -0.862 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 178.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 12.3 m -55.04 -45.9 75.26 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.434 1.094 . . . . 0.0 111.12 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.38 -57.12 12.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.091 -175.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -73.8 -36.55 65.01 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -174.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -70.14 -42.77 72.11 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 -178.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.456 HD21 ' HB3' ' A' ' 79' ' ' LEU . 48.8 tp -73.23 -24.69 60.52 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-O 120.765 0.317 . . . . 0.0 110.827 179.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.16 -42.34 66.02 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 175.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 30.7 m -68.83 -35.59 77.16 Favored 'General case' 0 CA--C 1.553 1.059 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.216 178.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 29.8 m -74.48 -26.64 60.14 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-O 121.36 0.6 . . . . 0.0 110.876 177.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.412 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 15.1 t70 -68.0 -48.53 65.49 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.1 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 7.6 p -69.71 -28.09 65.53 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.309 178.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.18 -36.72 83.83 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.414 0.685 . . . . 0.0 109.828 175.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 22.1 m -76.92 -14.3 59.88 Favored 'General case' 0 C--O 1.25 1.11 0 CA-C-O 121.612 0.72 . . . . 0.0 110.323 177.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 38.2 m80 73.98 -11.82 0.93 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.449 1.9 . . . . 0.0 114.286 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 5.5 p -160.43 172.01 18.03 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -172.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.84 144.83 56.58 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -132.62 -172.01 12.91 Favored Glycine 0 N--CA 1.427 -1.906 0 C-N-CA 118.939 -1.601 . . . . 0.0 114.553 -175.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 151.18 -137.47 6.06 Favored Glycine 0 N--CA 1.439 -1.115 0 N-CA-C 109.874 -1.29 . . . . 0.0 109.874 178.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 96.74 74.02 1.18 Allowed Glycine 0 N--CA 1.441 -1.021 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.394 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 17.8 m -64.63 107.62 1.46 Allowed 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.912 0.386 . . . . 0.0 110.52 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -123.95 159.85 18.55 Favored Glycine 0 N--CA 1.433 -1.547 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -135.2 55.84 0.72 Allowed Glycine 0 N--CA 1.44 -1.047 0 C-N-CA 120.664 -0.779 . . . . 0.0 113.045 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -76.73 116.32 4.61 Favored Glycine 0 C--O 1.247 0.959 0 N-CA-C 111.597 -0.601 . . . . 0.0 111.597 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' SER . . . . . 0.514 ' HB3' ' OE1' ' B' ' 138' ' ' GLU . 14.8 m -136.23 -176.46 4.33 Favored 'General case' 0 C--O 1.254 1.314 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -178.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 172.5 9.02 0.02 OUTLIER Glycine 0 CA--C 1.536 1.388 0 C-N-CA 120.738 -0.744 . . . . 0.0 114.128 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -109.03 -96.53 2.44 Favored Glycine 0 N--CA 1.441 -0.98 0 O-C-N 122.051 -0.676 . . . . 0.0 111.916 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . 0.516 ' O ' ' HG2' ' B' ' 138' ' ' GLU . . . 169.89 -150.85 15.58 Favored Glycine 0 N--CA 1.44 -1.061 0 C-N-CA 121.039 -0.6 . . . . 0.0 111.885 -178.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 29.0 m 67.26 -81.3 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 124.358 1.063 . . . . 0.0 112.4 179.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' B' ' 141' ' ' MET . 65.0 mt -106.23 -50.07 3.23 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-O 120.978 0.418 . . . . 0.0 111.032 -175.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' B' ' 135' ' ' GLY . 10.9 pt-20 -47.88 -36.3 11.91 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.889 1.811 . . . . 0.0 115.889 -168.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 14.2 p -65.15 -36.64 84.89 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.182 0.515 . . . . 0.0 112.16 -177.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -120.43 27.36 8.63 Favored 'General case' 0 CA--C 1.499 -0.999 0 CA-C-O 121.432 0.634 . . . . 0.0 109.443 -175.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.502 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 53.4 ttp -97.4 -15.77 20.52 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.509 -0.769 . . . . 0.0 113.002 -172.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -46.51 -58.09 4.1 Favored 'General case' 0 CA--C 1.568 1.646 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 -171.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 10.0 m -65.43 -39.57 92.26 Favored 'General case' 0 C--O 1.264 1.861 0 CA-C-O 121.922 0.868 . . . . 0.0 110.387 -176.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 47.1 mm -67.45 -44.87 86.53 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.133 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.365 -179.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.502 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 18.3 tt -67.82 -31.13 50.88 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-O 120.832 0.349 . . . . 0.0 111.494 -176.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -65.31 0.71 Allowed 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.062 171.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.7 p -61.1 -43.11 99.38 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -174.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -81.32 -46.69 14.35 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.507 ' HA ' ' HB3' ' A' ' 69' ' ' ALA 0.279 8.2 tt -88.16 -36.39 16.86 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -169.138 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.74 124.47 6.01 Favored 'General case' 0 CA--C 1.484 -1.591 0 C-N-CA 117.045 -1.862 . . . . 0.0 113.437 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -100.82 94.61 6.14 Favored 'General case' 0 C--N 1.277 -2.545 0 CA-C-N 114.107 -1.406 . . . . 0.0 109.004 176.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.274 -2.697 0 N-CA-C 106.134 -1.802 . . . . 0.0 106.134 173.532 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.554 0 N-CA-C 111.129 -0.789 . . . . 0.0 111.129 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 26.9 m -71.14 169.6 1.46 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.037 0 CA-C-O 121.075 0.464 . . . . 0.0 111.081 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.431 ' HA ' ' HD2' ' A' ' 3' ' ' ARG . 10.2 tpt180 -92.26 96.37 10.25 Favored 'General case' 0 N--CA 1.41 -2.45 0 C-N-CA 119.115 -1.034 . . . . 0.0 112.748 -171.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 82.9 mttt -127.19 124.92 40.11 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 114.269 -1.332 . . . . 0.0 108.292 175.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.58 -22.38 39.01 Favored Glycine 0 N--CA 1.464 0.56 0 O-C-N 123.904 0.752 . . . . 0.0 114.892 -173.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -74.97 -5.02 41.66 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 122.216 -0.579 . . . . 0.0 112.173 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -61.04 -26.59 67.73 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 117.98 0.354 . . . . 0.0 110.941 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -78.13 -7.05 56.52 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.595 0.712 . . . . 0.0 110.368 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 -102.35 3.14 37.65 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.817 -177.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.0 p -136.52 109.55 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.843 0 CA-C-O 122.157 0.98 . . . . 0.0 108.839 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.5 m -86.37 155.76 20.47 Favored 'General case' 0 C--N 1.286 -2.162 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.376 -175.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.71 -39.47 51.61 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.409 1.084 . . . . 0.0 110.928 177.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -57.43 -41.11 79.8 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 178.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.532 ' O ' HD11 ' A' ' 18' ' ' LEU . 3.1 tm? -69.02 -52.31 30.0 Favored 'General case' 0 CA--C 1.485 -1.543 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -175.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.592 ' O ' HG22 ' A' ' 19' ' ' VAL . 4.8 ptm180 -64.5 -44.67 90.22 Favored 'General case' 0 N--CA 1.413 -2.299 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.985 -176.156 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 t -64.21 -29.93 71.01 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.946 0.403 . . . . 0.0 110.038 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -66.18 -45.57 80.39 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.532 HD11 ' O ' ' A' ' 14' ' ' LEU . 4.9 mp -66.24 -39.42 89.52 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.739 177.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.592 HG22 ' O ' ' A' ' 15' ' ' ARG . 62.2 t -58.15 -50.18 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 124.329 1.052 . . . . 0.0 110.361 175.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -54.8 -46.56 74.51 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.483 177.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -65.94 -38.83 89.65 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.848 177.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.519 ' O ' HG22 ' A' ' 26' ' ' ILE . 20.7 mt -52.09 -49.31 63.84 Favored 'General case' 0 CA--C 1.498 -1.033 0 O-C-N 123.859 0.724 . . . . 0.0 110.023 174.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 71.2 t -56.62 -52.36 54.64 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.677 0 O-C-N 124.139 0.899 . . . . 0.0 109.825 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -53.58 -34.5 58.58 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -178.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.5 -45.9 15.3 Favored 'General case' 0 C--O 1.2 -1.539 0 CA-C-O 121.152 0.501 . . . . 0.0 111.917 176.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.526 HG13 ' CZ ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -75.31 -32.94 26.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-O 121.365 0.602 . . . . 0.0 110.679 -175.05 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.481 ' CD2' HG21 ' A' ' 26' ' ' ILE . 56.4 m-85 -128.56 91.57 43.22 Favored Pre-proline 0 C--N 1.283 -2.284 0 C-N-CA 124.801 1.24 . . . . 0.0 108.256 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.21 96.55 0.34 Allowed 'Trans proline' 0 N--CA 1.447 -1.224 0 C-N-CA 121.51 1.473 . . . . 0.0 110.062 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.8 t -52.64 123.56 31.1 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.879 -176.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.88 -16.88 29.28 Favored 'Trans proline' 0 C--O 1.237 0.451 0 C-N-CA 122.389 2.059 . . . . 0.0 112.27 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -163.39 148.54 9.26 Favored Pre-proline 0 N--CA 1.446 -0.638 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -174.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.413 ' O ' HD12 ' A' ' 35' ' ' LEU . 4.8 Cg_endo -52.57 -27.59 33.3 Favored 'Trans proline' 0 CA--C 1.559 1.749 0 C-N-CA 123.34 2.694 . . . . 0.0 113.172 173.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.63 -11.61 57.05 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 121.133 -0.98 . . . . 0.0 111.813 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.44 -42.1 30.93 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.085 0.469 . . . . 0.0 110.692 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 32' ' ' PRO 0.326 0.3 OUTLIER -75.84 8.51 3.02 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 178.039 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -133.06 17.97 4.11 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.408 0.623 . . . . 0.0 110.263 174.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.567 ' O ' ' HB3' ' A' ' 40' ' ' MET . 36.6 t70 -93.21 -178.38 4.75 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.721 -178.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.509 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.91 -22.45 62.25 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.916 -0.49 . . . . 0.0 110.46 179.246 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.555 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 42.3 ttm180 -73.27 -21.9 60.5 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.516 0.674 . . . . 0.0 109.716 176.176 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.647 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.4 tpp -61.55 -34.53 75.72 Favored 'General case' 0 C--O 1.197 -1.704 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.869 177.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.48 ' O ' ' HB1' ' A' ' 45' ' ' ALA . 12.9 pt-20 -66.97 -24.86 66.1 Favored 'General case' 0 C--O 1.2 -1.531 0 C-N-CA 118.33 -1.348 . . . . 0.0 110.844 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -74.28 -44.58 52.18 Favored 'General case' 0 C--O 1.249 1.063 0 CA-C-O 121.485 0.659 . . . . 0.0 109.548 174.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.4 mt -63.08 -49.12 75.75 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.504 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.647 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 2.6 p -70.58 -27.89 32.7 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.337 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.685 -178.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.48 ' HB1' ' O ' ' A' ' 41' ' ' GLU . . . -60.55 -44.31 96.28 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 176.257 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.526 ' CZ ' HG13 ' A' ' 26' ' ' ILE . 5.1 t80 -60.79 -47.76 84.85 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 173.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.81 -43.41 94.53 Favored 'General case' 0 C--O 1.197 -1.709 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.999 -176.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -64.0 -42.39 97.17 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 123.525 0.73 . . . . 0.0 112.06 177.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.4 pttp -68.01 -37.09 81.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.489 0.661 . . . . 0.0 110.056 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.478 HG23 ' CZ ' ' A' ' 46' ' ' TYR . 52.9 t -73.06 -49.41 38.93 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.576 178.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 13.8 tm-20 -56.62 -46.07 81.16 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 124.112 0.965 . . . . 0.0 109.202 178.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.419 ' O ' ' HG2' ' A' ' 56' ' ' GLU . . . -58.01 -48.19 84.24 Favored Glycine 0 N--CA 1.432 -1.609 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.88 178.307 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -56.71 -51.16 69.87 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.118 0.485 . . . . 0.0 111.781 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.412 ' HE3' ' HB3' ' A' ' 54' ' ' MET . 0.3 OUTLIER -67.99 -29.62 68.68 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 179.139 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.416 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 65.6 t80 -62.75 -51.52 66.83 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 176.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 52' ' ' GLY . 5.9 mm-40 -71.95 -24.48 61.62 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.691 -177.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 t -79.55 -22.05 44.33 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.312 0.577 . . . . 0.0 110.183 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -93.15 162.81 13.87 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 121.157 0.504 . . . . 0.0 111.171 -177.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -118.51 19.01 13.45 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.647 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.5 p -167.21 157.2 10.98 Favored 'General case' 0 CA--C 1.488 -1.441 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 171.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.29 -26.1 61.84 Favored 'General case' 0 C--N 1.308 -1.196 0 C-N-CA 119.241 -0.984 . . . . 0.0 111.432 179.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -65.53 -47.37 76.15 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.87 -47.31 86.27 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.865 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.19 -46.63 79.97 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.963 -176.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.493 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 2.4 t80 -60.99 -43.43 98.88 Favored 'General case' 0 C--O 1.203 -1.351 0 O-C-N 123.8 0.687 . . . . 0.0 110.301 178.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 31.8 t-80 -62.88 -54.66 35.24 Favored 'General case' 0 C--O 1.214 -0.789 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.412 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.1 pp -65.39 -33.64 76.43 Favored 'General case' 0 C--O 1.272 2.286 0 CA-C-O 121.413 0.625 . . . . 0.0 111.634 -175.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.499 HD21 HD22 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -73.79 -35.29 64.9 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.236 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.434 ' HA ' HG23 ' A' ' 72' ' ' ILE . . . -63.78 -34.49 78.02 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.159 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -68.44 -46.76 69.0 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 120.134 -0.626 . . . . 0.0 110.055 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -64.73 -36.83 85.55 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 119.501 -0.88 . . . . 0.0 111.512 -179.038 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.523 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 8.9 tt -69.31 -47.07 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.576 179.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.485 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 23.0 t80 -51.68 -49.94 61.4 Favored 'General case' 0 C--O 1.256 1.427 0 C-N-CA 125.889 1.676 . . . . 0.0 111.063 178.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -67.35 -34.64 77.74 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.679 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.79 -34.83 66.68 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 CA-C-O 120.603 0.239 . . . . 0.0 111.086 177.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 72' ' ' ILE . 22.1 mm-40 -62.06 -49.52 75.67 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.591 ' HZ2' ' HB3' ' A' ' 77' ' ' LYS . 0.5 OUTLIER -71.92 -31.04 65.97 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 119.656 -0.818 . . . . 0.0 113.088 177.491 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -57.92 -50.35 73.65 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 175.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -64.93 -36.95 86.04 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.379 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -61.01 -53.54 56.01 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.131 0.572 . . . . 0.0 111.612 177.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -69.5 -39.8 77.4 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.854 -177.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.61 -34.23 77.76 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -178.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -77.76 -40.89 39.42 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.904 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.9 tpp180 -71.84 -59.43 2.75 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.256 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 39.1 m 166.13 87.69 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 126.72 2.008 . . . . 0.0 109.757 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -97.14 -28.74 13.97 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 174.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 69.7 mt . . . . . 0 C--O 1.251 1.176 0 CA-C-N 113.859 -1.519 . . . . 0.0 109.02 177.533 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.593 0 N-CA-C 111.28 -0.728 . . . . 0.0 111.28 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 13.9 t -97.36 -36.78 10.27 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 92.9 mmm -85.84 -17.64 35.08 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.853 0.835 . . . . 0.0 110.159 177.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 16.7 t -95.11 109.91 21.92 Favored 'General case' 0 N--CA 1.411 -2.412 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 174.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -86.06 154.8 21.15 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 120.089 -0.644 . . . . 0.0 110.871 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . 0.407 ' HA ' ' OE1' ' B' ' 109' ' ' GLN . 51.9 p90 -171.94 160.83 5.56 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 106.141 -1.799 . . . . 0.0 106.141 -174.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . 0.431 ' C ' ' H ' ' B' ' 109' ' ' GLN . . . 78.26 -59.43 3.99 Favored Glycine 0 C--N 1.308 -0.974 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 -178.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -74.66 27.88 0.09 Allowed 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 125.477 1.511 . . . . 0.0 112.902 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . 0.546 HE21 ' HA ' ' B' ' 109' ' ' GLN . 0.0 OUTLIER -71.37 -36.31 71.4 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.837 -175.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 3.8 p -71.1 -38.78 72.37 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.848 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 31.8 tp -57.17 -58.06 9.88 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.701 176.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -67.78 -37.3 81.88 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.779 -176.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -63.72 -52.6 59.79 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.97 -30.32 68.71 Favored 'General case' 0 C--O 1.207 -1.151 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.603 -178.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.3 tp -65.37 -36.93 85.48 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 176.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 62.4 m -64.36 -46.39 83.6 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.404 ' O ' ' HB3' ' B' ' 120' ' ' LEU . 14.7 m -67.03 -34.69 78.25 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.974 178.392 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -64.91 -34.1 77.6 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 123.901 0.881 . . . . 0.0 108.85 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 38.9 m -71.93 -25.49 61.92 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.658 177.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . 0.404 ' HB3' ' O ' ' B' ' 117' ' ' SER . 8.0 tt -66.14 -45.66 80.25 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 16.7 m -64.52 -49.8 69.89 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 174.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 18.2 t60 71.37 -62.0 0.47 Allowed 'General case' 0 C--N 1.341 0.203 0 C-N-CA 125.722 1.609 . . . . 0.0 112.054 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 36.3 p -96.13 76.46 3.06 Favored 'General case' 0 N--CA 1.417 -2.08 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.635 -176.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 44.7 t0 68.54 176.27 0.27 Allowed 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 124.434 1.094 . . . . 0.0 112.103 175.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -157.45 130.64 2.67 Favored Glycine 0 N--CA 1.435 -1.426 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -151.01 103.77 0.25 Allowed Glycine 0 N--CA 1.437 -1.238 0 C-N-CA 120.447 -0.883 . . . . 0.0 113.306 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -134.46 149.41 19.81 Favored Glycine 0 C--N 1.305 -1.165 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 44.8 m -141.0 173.22 11.69 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 117.904 0.852 . . . . 0.0 111.535 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -156.61 130.19 2.62 Favored Glycine 0 N--CA 1.435 -1.42 0 N-CA-C 109.126 -1.59 . . . . 0.0 109.126 176.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -108.1 -168.36 21.4 Favored Glycine 0 C--N 1.302 -1.35 0 C-N-CA 120.018 -1.087 . . . . 0.0 112.682 -176.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -124.51 178.56 16.44 Favored Glycine 0 N--CA 1.434 -1.486 0 N-CA-C 110.229 -1.148 . . . . 0.0 110.229 178.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.0 t -178.48 -77.23 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -178.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -111.79 159.05 13.94 Favored Glycine 0 N--CA 1.432 -1.612 0 N-CA-C 109.219 -1.552 . . . . 0.0 109.219 174.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -162.27 99.68 0.17 Allowed Glycine 0 N--CA 1.425 -2.058 0 C-N-CA 119.911 -1.137 . . . . 0.0 112.685 -178.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -159.06 16.94 0.25 Allowed Glycine 0 C--N 1.305 -1.149 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 177.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 136' ' ' SER . . . . . 0.485 ' HB3' ' H ' ' B' ' 140' ' ' ASP . 22.8 t -167.34 165.8 14.89 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 -176.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.543 ' O ' ' HB3' ' B' ' 141' ' ' MET . 2.7 pt? -93.72 -47.21 6.89 Favored 'General case' 0 C--O 1.184 -2.349 0 C-N-CA 119.486 -0.886 . . . . 0.0 109.863 174.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.401 ' HB3' ' HB2' ' A' ' 14' ' ' LEU 0.277 19.5 pt-20 -85.64 -28.81 24.52 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 116.489 2.033 . . . . 0.0 116.489 -177.88 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 44.2 t -100.36 -61.36 1.38 Allowed 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 118.984 -1.086 . . . . 0.0 112.922 -174.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . 0.485 ' H ' ' HB3' ' B' ' 136' ' ' SER . 13.9 m-20 -115.91 82.83 1.83 Allowed 'General case' 0 CA--C 1.476 -1.898 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -178.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.543 ' HB3' ' O ' ' B' ' 137' ' ' LEU . 17.8 ptm -103.0 -37.21 7.88 Favored 'General case' 0 C--O 1.181 -2.544 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -167.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -26.92 -61.1 0.09 Allowed 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -167.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 28.5 m -71.27 -38.19 71.88 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.834 -0.541 . . . . 0.0 111.671 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 48.0 mm -68.68 -47.56 75.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.493 ' HA ' ' OH ' ' A' ' 65' ' ' TYR . 7.9 tp -61.75 -39.07 82.01 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.307 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 41.3 ttt180 -65.35 -49.5 69.11 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 118.573 -1.251 . . . . 0.0 110.82 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 28.9 m -66.08 -44.84 83.28 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.0 -40.28 39.57 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 121.076 -0.249 . . . . 0.0 111.586 -175.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.514 HD11 ' SD ' ' B' ' 150' ' ' MET . 2.8 tm? -79.48 -50.73 10.31 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.358 -173.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.514 ' SD ' HD11 ' B' ' 149' ' ' LEU . 0.0 OUTLIER -149.4 83.49 1.42 Allowed 'General case' 0 C--O 1.244 0.768 0 C-N-CA 118.027 -1.469 . . . . 0.0 114.483 -178.406 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 76.39 149.77 0.11 Allowed 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 169.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.116 0 CA-C-N 114.393 -1.276 . . . . 0.0 108.293 177.063 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.568 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.0 m -94.58 134.46 31.97 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -102.82 110.37 22.27 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 121.724 0.773 . . . . 0.0 111.706 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.601 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.2 ptpt -152.08 84.29 1.27 Allowed 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 114.58 -1.191 . . . . 0.0 110.175 177.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.02 -8.4 8.33 Favored Glycine 0 C--O 1.243 0.669 0 CA-C-N 114.29 -1.323 . . . . 0.0 115.471 -173.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.601 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 59.7 p-90 -62.48 -16.25 54.4 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 117.129 0.465 . . . . 0.0 111.405 177.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.434 ' HB2' ' HH ' ' A' ' 55' ' ' TYR . 9.7 p80 -59.97 -11.84 6.6 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 178.294 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -89.82 -8.31 52.35 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.034 0.445 . . . . 0.0 110.336 178.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -107.6 13.61 26.51 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.628 0.728 . . . . 0.0 111.042 -174.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.3 p -134.14 110.52 13.86 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.205 0 CA-C-O 122.156 0.979 . . . . 0.0 108.598 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.9 m -81.16 154.35 26.76 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.197 -173.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.49 -34.84 73.08 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.415 178.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.98 -39.21 81.05 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.941 176.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.519 ' O ' HD12 ' A' ' 18' ' ' LEU . 2.9 tm? -69.67 -52.43 25.82 Favored 'General case' 0 CA--C 1.493 -1.247 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 -177.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.564 ' O ' HG21 ' A' ' 19' ' ' VAL . 6.2 ptm180 -65.1 -44.17 89.7 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.882 -175.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.0 t -66.52 -27.13 67.52 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 24.9 t60 -67.62 -46.31 72.87 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 14' ' ' LEU . 5.1 mp -63.89 -38.99 93.13 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.698 177.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.564 HG21 ' O ' ' A' ' 15' ' ' ARG . 75.6 t -58.19 -48.38 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 123.644 0.778 . . . . 0.0 109.972 174.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.522 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 18.5 t-80 -55.37 -45.85 76.5 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.445 0.698 . . . . 0.0 110.351 177.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.1 mttp -65.67 -38.65 89.87 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.87 178.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.99 -44.65 82.91 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.522 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 25.1 t -53.73 -49.36 57.91 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.906 0 C-N-CA 124.055 0.942 . . . . 0.0 110.931 172.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -69.61 -25.86 64.16 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.029 -0.668 . . . . 0.0 112.58 -176.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.427 ' O ' HD11 ' B' ' 114' ' ' LEU . . . -78.83 -42.18 28.3 Favored 'General case' 0 C--O 1.196 -1.732 0 C-N-CA 120.971 -0.292 . . . . 0.0 110.747 174.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.9 tt -70.68 -38.82 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 119.902 -0.719 . . . . 0.0 111.194 179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -125.52 99.09 33.61 Favored Pre-proline 0 N--CA 1.415 -2.192 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -175.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.43 97.84 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 121.735 1.623 . . . . 0.0 108.815 170.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.0 t -75.8 136.68 70.24 Favored Pre-proline 0 N--CA 1.426 -1.664 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.624 -176.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.48 -21.3 11.68 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 122.498 2.132 . . . . 0.0 111.677 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -158.31 141.93 11.11 Favored Pre-proline 0 CA--C 1.496 -1.133 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -176.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -55.49 -20.04 25.16 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.913 2.409 . . . . 0.0 114.61 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.9 -10.04 59.41 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 121.171 -0.956 . . . . 0.0 112.03 179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -6.56 55.24 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.179 0.99 . . . . 0.0 108.828 174.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.511 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.4 mt -90.94 5.65 47.85 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.22 -179.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.485 ' HB3' ' HZ1' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -133.13 26.96 4.21 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 176.1 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.562 ' O ' ' HB3' ' A' ' 40' ' ' MET . 22.7 t70 -92.29 173.08 8.0 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.627 -1.169 . . . . 0.0 109.424 -177.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.527 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.26 -25.94 62.68 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.209 0.528 . . . . 0.0 110.324 177.811 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.488 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 33.7 ttm180 -72.19 -27.43 62.55 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-O 121.589 0.709 . . . . 0.0 109.951 176.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.626 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 4.8 tpp -57.25 -37.41 72.26 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.242 178.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.535 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 11.6 pt-20 -61.44 -29.08 69.72 Favored 'General case' 0 C--O 1.202 -1.407 0 C-N-CA 119.023 -1.071 . . . . 0.0 110.245 -179.219 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.488 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.3 t30 -69.68 -48.63 59.03 Favored 'General case' 0 C--O 1.253 1.25 0 C-N-CA 122.849 0.46 . . . . 0.0 109.993 175.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.477 HD21 ' O ' ' A' ' 39' ' ' ARG . 2.7 mm? -61.97 -51.61 67.37 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.274 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.626 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -67.77 -29.21 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.832 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.082 -176.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -60.74 -45.96 92.27 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.097 0.475 . . . . 0.0 109.865 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.498 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 1.7 t80 -62.38 -46.86 86.72 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.622 174.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.81 91.54 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.092 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -64.75 -44.28 90.59 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 123.742 0.817 . . . . 0.0 112.487 177.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.7 pttp -64.77 -39.94 94.44 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-O 121.489 0.661 . . . . 0.0 109.532 -178.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.1 t -67.68 -53.24 32.84 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.978 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -55.4 -48.33 74.52 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 124.036 0.934 . . . . 0.0 110.02 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.37 -37.79 94.65 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.486 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -64.52 -47.76 77.64 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 121.398 0.618 . . . . 0.0 110.718 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.404 ' CB ' HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -70.28 -29.49 66.27 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 121.817 -0.552 . . . . 0.0 112.11 176.688 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.434 ' HH ' ' HB2' ' A' ' 7' ' ' HIS . 62.6 t80 -62.9 -54.7 34.54 Favored 'General case' 0 C--O 1.193 -1.873 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 177.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -68.99 -27.2 65.48 Favored 'General case' 0 C--N 1.307 -1.252 0 O-C-N 122.027 -0.421 . . . . 0.0 111.563 -177.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.2 t -74.34 -32.97 62.99 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 123.504 0.721 . . . . 0.0 112.455 -178.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.03 159.92 30.33 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -174.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -98.93 -1.98 38.65 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.171 178.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.447 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 66.4 p -168.17 158.0 9.84 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.529 174.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -35.62 80.05 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -67.57 -33.67 75.5 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -70.75 -44.76 66.09 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.683 175.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -45.8 89.14 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.455 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 1.3 t80 -60.74 -46.59 89.83 Favored 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.031 176.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -59.18 -52.04 67.42 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.404 HD13 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -67.88 -37.63 82.02 Favored 'General case' 0 C--O 1.267 2.016 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.944 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.497 HD21 HD22 ' A' ' 18' ' ' LEU . 1.5 pp -68.9 -36.62 78.26 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.481 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -64.02 -41.21 97.52 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.607 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -62.77 -46.42 88.11 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.542 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -38.07 69.94 Favored 'General case' 0 N--CA 1.438 -1.047 0 C-N-CA 118.935 -1.106 . . . . 0.0 112.14 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.499 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 4.2 tt -65.26 -45.83 92.46 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.15 178.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.484 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 17.8 t80 -53.29 -53.34 52.37 Favored 'General case' 0 C--O 1.272 2.259 0 C-N-CA 125.37 1.468 . . . . 0.0 111.409 178.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.497 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.3 ptpt -63.72 -34.22 77.39 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.756 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.415 HD11 ' HG1' ' B' ' 110' ' ' THR . 1.4 mp -67.78 -40.78 84.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 O-C-N 123.5 0.5 . . . . 0.0 111.913 177.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.581 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.4 mm-40 -57.96 -53.59 56.57 Favored 'General case' 0 C--O 1.253 1.239 0 CA-C-O 121.967 0.889 . . . . 0.0 109.554 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.546 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 12.2 ptpt -70.3 -32.53 70.35 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 118.977 -1.089 . . . . 0.0 112.888 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 18.6 tp10 -62.34 -46.35 89.07 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.2 pp -63.45 -43.27 97.86 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.042 -177.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.489 ' N ' HD11 ' A' ' 79' ' ' LEU . 7.2 pt-20 -69.38 -43.82 72.74 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 118.809 -1.156 . . . . 0.0 112.156 -178.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 13.3 pt-20 -69.98 -32.27 70.4 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 120.325 -0.55 . . . . 0.0 112.066 -178.008 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.57 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.3 OUTLIER -72.93 -35.5 67.02 Favored 'General case' 0 C--O 1.215 -0.761 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.221 177.647 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.405 ' HD3' ' OD2' ' B' ' 118' ' ' ASP . 18.5 tpt180 -71.23 -31.54 67.69 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.149 -179.333 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -101.7 -54.39 2.75 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 -173.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 30.7 p -120.54 -30.22 4.57 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 118.491 2.775 . . . . 0.0 118.491 -167.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.57 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 3.1 ptp180 -88.15 -23.05 23.74 Favored 'General case' 0 C--N 1.27 -2.866 0 C-N-CA 117.976 -1.49 . . . . 0.0 111.482 -175.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 57.1 mt . . . . . 0 C--O 1.248 0.978 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 178.49 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.885 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 23.3 m -86.27 87.22 7.39 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 83.6 mmm -93.78 -26.99 16.73 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.78 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' SER . . . . . 0.49 ' HA ' ' NE2' ' B' ' 112' ' ' GLN . 22.9 t -90.73 -167.92 1.95 Allowed 'General case' 0 N--CA 1.426 -1.672 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.696 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . 0.49 ' O ' ' HB3' ' B' ' 109' ' ' GLN . 51.2 m-70 -133.95 172.01 13.39 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 -176.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -111.84 112.88 24.87 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 173.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 103.45 -71.83 0.28 Allowed Glycine 0 N--CA 1.429 -1.832 0 N-CA-C 110.78 -0.928 . . . . 0.0 110.78 -175.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -82.9 20.35 1.2 Allowed 'General case' 0 N--CA 1.478 0.929 0 CA-C-O 121.418 0.628 . . . . 0.0 111.547 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . 0.49 ' HB3' ' O ' ' B' ' 105' ' ' HIS . 2.5 pp0? -62.82 -18.52 62.94 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.39 0.615 . . . . 0.0 110.262 173.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' THR . . . . . 0.556 ' O ' ' HB2' ' B' ' 114' ' ' LEU . 1.0 OUTLIER -60.03 -24.64 64.68 Favored 'General case' 0 N--CA 1.411 -2.415 0 C-N-CA 125.428 1.491 . . . . 0.0 112.25 179.3 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.23 -58.57 8.04 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.243 0.544 . . . . 0.0 110.324 176.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . 0.49 ' NE2' ' HA ' ' B' ' 104' ' ' SER . 10.2 pt20 -76.04 -28.78 57.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.665 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . 0.459 ' HB3' ' HA ' ' B' ' 110' ' ' THR . 26.0 t70 -65.59 -45.26 83.89 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.88 176.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.556 ' HB2' ' O ' ' B' ' 110' ' ' THR . 0.1 OUTLIER -69.61 -31.59 69.81 Favored 'General case' 0 C--O 1.191 -2.007 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.524 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 58.9 tp -62.37 -33.35 74.57 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 121.211 0.529 . . . . 0.0 110.135 175.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 40.9 m -72.15 -43.69 64.25 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.477 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.509 ' O ' ' HB3' ' B' ' 120' ' ' LEU . 13.5 p -73.52 -26.89 61.08 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-O 121.442 0.639 . . . . 0.0 110.909 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.559 ' CG ' ' HZ3' ' A' ' 82' ' ' LYS . 5.4 t70 -62.34 -42.85 99.73 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 124.456 1.102 . . . . 0.0 109.695 173.095 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 20.6 t -67.98 -33.49 74.74 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.277 178.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . 0.509 ' HB3' ' O ' ' B' ' 117' ' ' SER . 4.2 tt -62.65 -51.16 68.34 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 46.2 m -60.96 -53.22 59.88 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.559 177.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 60.08 29.93 19.45 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.549 1.139 . . . . 0.0 109.844 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 4.6 p -148.37 170.72 17.34 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.263 -176.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -90.65 135.79 33.48 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 122.358 0.263 . . . . 0.0 110.814 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -167.71 175.11 42.72 Favored Glycine 0 N--CA 1.432 -1.616 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -179.18 37.74 0.08 OUTLIER Glycine 0 C--N 1.307 -1.031 0 N-CA-C 111.124 -0.79 . . . . 0.0 111.124 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.24 -177.02 53.82 Favored Glycine 0 N--CA 1.438 -1.199 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.959 178.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 36.9 m -147.99 134.41 19.64 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 155.61 146.44 4.44 Favored Glycine 0 N--CA 1.432 -1.621 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -105.79 -127.32 5.88 Favored Glycine 0 N--CA 1.435 -1.415 0 N-CA-C 110.173 -1.171 . . . . 0.0 110.173 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . 0.432 ' HA2' ' HB3' ' B' ' 142' ' ' GLU . . . 162.68 88.15 0.07 OUTLIER Glycine 0 N--CA 1.427 -1.928 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.112 177.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 4.9 p -91.69 -45.61 8.36 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 113.523 0.934 . . . . 0.0 113.523 178.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . 0.539 ' O ' ' HB2' ' B' ' 142' ' ' GLU . . . -158.69 146.29 12.91 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 119.003 -1.57 . . . . 0.0 113.378 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -156.46 147.41 15.87 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 110.481 -1.047 . . . . 0.0 110.481 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -148.71 11.26 1.1 Allowed Glycine 0 C--O 1.241 0.586 0 N-CA-C 112.147 -0.381 . . . . 0.0 112.147 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.6 t -163.88 -167.19 1.31 Allowed 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.597 ' O ' ' HB3' ' B' ' 141' ' ' MET . 2.3 pt? -105.31 -49.54 3.43 Favored 'General case' 0 C--O 1.191 -2.003 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.32 178.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . 0.479 ' HA ' HD22 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.46 -44.8 14.35 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 -171.917 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 28.3 t -87.28 -54.25 4.4 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.738 -176.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -129.39 95.77 4.11 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -177.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 141' ' ' MET . . . . . 0.597 ' HB3' ' O ' ' B' ' 137' ' ' LEU . 21.5 ptp -102.36 -39.3 7.24 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 117.027 2.232 . . . . 0.0 117.027 -168.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.539 ' HB2' ' O ' ' B' ' 133' ' ' GLY . 47.1 mt-10 -21.92 -64.77 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 118.717 2.858 . . . . 0.0 118.717 -165.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 19.4 p -67.65 -44.69 77.3 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.172 0.511 . . . . 0.0 111.721 -171.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 57.2 mt -66.55 -46.6 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.946 -178.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . 0.483 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 18.2 tt -67.65 -33.36 61.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -69.64 -52.45 25.77 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.642 176.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.3 m -64.85 -41.81 95.39 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -176.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -81.08 -39.89 24.99 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -177.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.483 ' HB3' ' O ' ' B' ' 145' ' ' ILE . 8.3 tt -98.46 -30.24 12.65 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 -169.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 25.7 ptm -166.17 119.18 1.08 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -176.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -93.15 120.84 33.89 Favored 'General case' 0 CA--C 1.489 -1.394 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 166.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.294 -1.837 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -177.84 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.491 -1.459 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.6 m -92.88 143.07 12.19 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 175.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.0 60.67 6.39 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-O 122.039 0.923 . . . . 0.0 112.299 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.41 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 79.3 mttt -138.97 114.12 9.49 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.008 -179.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.31 -20.55 10.43 Favored Glycine 0 N--CA 1.466 0.648 0 N-CA-C 115.69 1.036 . . . . 0.0 115.69 -174.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.41 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 67.2 p-90 -70.39 -12.57 61.67 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 122.287 -0.537 . . . . 0.0 111.986 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -58.96 -21.2 58.05 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-O 120.92 0.391 . . . . 0.0 111.955 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -82.38 -13.48 56.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.477 0.656 . . . . 0.0 110.316 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.406 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 21.0 m-70 -94.24 2.26 55.91 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.218 -176.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.435 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.9 p -129.12 110.86 21.44 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 CA-C-O 121.416 0.627 . . . . 0.0 110.07 -177.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 m -88.72 157.19 18.6 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.928 -176.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.59 -37.32 62.85 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.841 0.856 . . . . 0.0 111.267 178.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.07 -35.36 80.01 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.543 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.2 tm? -70.49 -52.0 25.03 Favored 'General case' 0 CA--C 1.488 -1.438 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -176.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.526 ' O ' HG23 ' A' ' 19' ' ' VAL . 3.7 ptm180 -63.32 -44.62 94.43 Favored 'General case' 0 N--CA 1.42 -1.96 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.996 -178.276 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 t -61.95 -31.49 71.84 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.785 0.326 . . . . 0.0 110.445 178.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -66.66 -45.47 78.84 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.543 HD12 ' O ' ' A' ' 14' ' ' LEU . 7.0 mp -67.32 -40.84 86.01 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.221 178.365 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 15' ' ' ARG . 54.6 t -56.47 -49.96 74.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 124.306 1.043 . . . . 0.0 109.828 175.012 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -58.12 -44.12 87.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.095 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -66.6 -40.92 89.1 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.931 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.539 ' O ' HG22 ' A' ' 26' ' ' ILE . 11.7 mt -50.83 -51.12 54.19 Favored 'General case' 0 CA--C 1.5 -0.959 0 O-C-N 124.211 0.944 . . . . 0.0 109.057 173.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.455 HG13 ' CE ' ' A' ' 40' ' ' MET . 79.2 t -55.23 -52.89 40.66 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.799 0 O-C-N 124.484 1.115 . . . . 0.0 111.05 175.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -52.46 -35.83 53.38 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.89 -46.48 14.03 Favored 'General case' 0 C--O 1.2 -1.518 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 176.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.601 HG21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.5 -24.76 14.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-O 122.218 1.009 . . . . 0.0 110.499 -174.111 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.601 ' CD2' HG21 ' A' ' 26' ' ' ILE . 75.1 m-85 -131.01 86.52 51.53 Favored Pre-proline 0 C--N 1.271 -2.828 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.497 178.384 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -61.22 104.88 0.31 Allowed 'Trans proline' 0 N--CA 1.441 -1.57 0 N-CA-C 108.636 -1.332 . . . . 0.0 108.636 175.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.9 t -72.68 143.03 84.29 Favored Pre-proline 0 N--CA 1.422 -1.865 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.751 -173.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -77.94 -29.51 4.25 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.226 2.618 . . . . 0.0 111.073 175.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -137.72 135.92 19.54 Favored Pre-proline 0 CA--C 1.493 -1.215 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -176.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -63.8 -18.42 63.92 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 121.472 1.448 . . . . 0.0 111.587 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.7 -15.25 55.04 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 121.748 -0.595 . . . . 0.0 111.189 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.76 -16.21 63.27 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 121.468 0.652 . . . . 0.0 109.353 175.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.5 mt -81.02 3.4 23.21 Favored 'General case' 0 C--O 1.214 -0.809 0 CA-C-N 114.496 -1.229 . . . . 0.0 110.547 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.81 10.85 2.89 Favored 'General case' 0 C--N 1.288 -2.095 0 O-C-N 121.366 -0.834 . . . . 0.0 110.099 170.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.431 ' O ' ' HB3' ' A' ' 40' ' ' MET . 1.9 t70 -104.72 -167.3 1.33 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.202 -170.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -36.39 81.23 Favored 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 118.264 0.484 . . . . 0.0 111.632 -177.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.535 ' O ' HD13 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -64.55 -33.82 76.8 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -177.864 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.57 ' O ' HG23 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.77 -33.45 71.7 Favored 'General case' 0 C--O 1.171 -3.074 0 CA-C-O 118.435 -0.793 . . . . 0.0 111.1 -178.899 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -64.05 -34.18 77.43 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.235 0.925 . . . . 0.0 110.477 -176.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -71.81 -45.62 60.92 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.819 0.818 . . . . 0.0 109.379 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.535 HD13 ' O ' ' A' ' 39' ' ' ARG . 0.3 OUTLIER -57.01 -52.61 64.59 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 113.946 -1.479 . . . . 0.0 110.808 -179.147 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 40' ' ' MET . 27.6 m -69.97 -32.02 50.0 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.487 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.347 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.64 -48.86 74.28 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 175.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.517 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 9.7 t80 -63.92 -48.66 75.69 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.943 174.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.03 -40.66 94.43 Favored 'General case' 0 C--O 1.196 -1.752 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.498 -176.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 mttm -66.09 -42.28 89.54 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 123.676 0.79 . . . . 0.0 111.533 178.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.0 pttp -65.47 -40.65 93.4 Favored 'General case' 0 C--O 1.254 1.309 0 CA-C-O 121.443 0.639 . . . . 0.0 110.19 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.418 HG22 ' CZ ' ' A' ' 46' ' ' TYR . 78.3 t -71.56 -47.5 57.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.519 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -57.93 -47.68 82.15 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 123.53 0.732 . . . . 0.0 109.269 179.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.31 -39.46 92.65 Favored Glycine 0 CA--C 1.505 -0.551 0 O-C-N 123.673 0.608 . . . . 0.0 112.104 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.0 -54.26 48.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.034 0.445 . . . . 0.0 110.804 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.422 ' HE3' ' HB3' ' A' ' 54' ' ' MET . 0.3 OUTLIER -67.89 -29.3 68.37 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 179.019 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -61.63 -54.39 43.54 Favored 'General case' 0 C--O 1.2 -1.526 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 176.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -74.02 -22.12 59.7 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.826 -0.546 . . . . 0.0 111.815 -176.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -79.96 -21.5 43.7 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-O 120.715 0.293 . . . . 0.0 111.01 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.05 165.14 17.76 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -176.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -107.08 -0.74 22.68 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.306 177.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.9 p -162.86 159.08 23.42 Favored 'General case' 0 CA--C 1.482 -1.648 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.28 -24.73 61.39 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 119.016 -1.074 . . . . 0.0 110.344 178.531 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -63.62 -47.31 81.9 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -63.23 -47.98 80.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.785 176.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -45.7 92.66 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 123.156 0.285 . . . . 0.0 110.753 -176.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -62.2 -47.01 86.34 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.961 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.489 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 14.6 t60 -57.78 -54.59 45.12 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.408 0.443 . . . . 0.0 111.195 -178.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.404 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.5 pp -67.71 -32.11 72.52 Favored 'General case' 0 C--O 1.245 0.833 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -175.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.481 HD23 HD22 ' A' ' 18' ' ' LEU . 1.2 pp -75.65 -31.0 59.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.774 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.444 ' HA ' HG21 ' A' ' 72' ' ' ILE . . . -67.23 -34.22 77.0 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.948 176.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 10.6 mm-40 -66.8 -44.34 81.48 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.631 0.729 . . . . 0.0 109.318 176.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.443 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -66.64 -42.59 86.45 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.096 -179.059 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.444 HG21 ' HA ' ' A' ' 69' ' ' ALA . 6.0 tt -65.12 -46.61 90.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 C-N-CA 119.999 -0.681 . . . . 0.0 110.67 -178.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.69 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 59.4 t80 -50.65 -54.23 24.59 Favored 'General case' 0 C--O 1.268 2.043 0 C-N-CA 125.808 1.643 . . . . 0.0 110.764 177.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 18.5 ptpt -63.74 -31.66 72.9 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.705 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.76 -37.57 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.475 177.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . 0.552 ' OE1' ' HB2' ' B' ' 150' ' ' MET . 31.4 mt-30 -68.04 -42.04 81.16 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.832 -177.229 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.69 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.4 OUTLIER -70.24 -30.4 67.46 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 119.199 -1.001 . . . . 0.0 112.205 176.27 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.82 -45.42 89.7 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 176.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -65.95 -41.2 91.59 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 16.0 pt-20 -69.86 -41.61 74.62 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.593 -177.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 8.4 pt-20 -65.79 -44.41 85.83 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.308 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -65.18 -42.37 93.72 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.158 -175.952 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 54.4 ttp180 -77.69 -26.71 50.43 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 120.93 -0.308 . . . . 0.0 110.89 -178.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -71.57 -59.55 2.7 Favored 'General case' 0 C--O 1.245 0.848 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.951 -176.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.3 m -157.06 30.85 0.3 Allowed 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -171.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 82' ' ' LYS . 10.1 ptm180 -77.48 -19.25 56.2 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 116.895 -1.922 . . . . 0.0 109.49 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.7 mm? . . . . . 0 C--O 1.243 0.749 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.583 177.936 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.013 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 26.4 m -85.14 86.97 7.34 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 21.7 mmt -93.93 1.69 56.27 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.162 -178.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' SER . . . . . 0.504 ' HA ' ' CD ' ' B' ' 109' ' ' GLN . 7.6 t 66.19 23.94 10.84 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.293 1.437 . . . . 0.0 110.792 176.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -82.1 -20.34 38.32 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.281 0.562 . . . . 0.0 110.43 -178.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -76.66 -48.86 17.69 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 121.519 0.676 . . . . 0.0 112.349 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.61 -45.07 1.36 Allowed Glycine 0 C--N 1.273 -2.935 0 N-CA-C 108.852 -1.699 . . . . 0.0 108.852 -175.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -107.84 17.57 22.34 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.136 -0.532 . . . . 0.0 110.244 179.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' GLN . . . . . 0.504 ' CD ' ' HA ' ' B' ' 104' ' ' SER . 5.2 pm0 -57.06 -32.36 66.14 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.645 177.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 2.2 t -55.4 -48.73 73.91 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 123.662 0.601 . . . . 0.0 111.221 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 58.5 tp -66.84 -39.75 87.72 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.309 -176.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -70.71 -45.87 64.15 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 120.798 0.332 . . . . 0.0 111.202 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -61.37 -43.51 98.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.655 0.74 . . . . 0.0 109.039 176.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 114' ' ' LEU . . . . . 0.446 HD23 ' HB3' ' A' ' 79' ' ' LEU . 40.6 tp -68.98 -32.31 71.78 Favored 'General case' 0 C--O 1.188 -2.175 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.4 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.4 tp -69.9 -45.41 67.69 Favored 'General case' 0 C--O 1.246 0.907 0 O-C-N 121.88 -0.513 . . . . 0.0 110.412 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 35.7 m -61.56 -33.2 73.44 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.01 177.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 117' ' ' SER . . . . . 0.63 ' O ' ' HG ' ' B' ' 120' ' ' LEU . 19.8 m -77.67 -43.49 31.07 Favored 'General case' 0 CA--C 1.56 1.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.808 176.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.432 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 6.7 t70 -62.06 -34.26 75.94 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.799 1.24 . . . . 0.0 111.339 -175.06 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 2.6 p -62.12 -12.23 18.42 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -176.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' B' ' 117' ' ' SER . 2.3 pp -87.18 -10.11 53.48 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.266 176.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 27.8 t -76.43 -57.63 3.75 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.593 -176.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 70.71 -53.68 0.66 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.668 1.187 . . . . 0.0 109.37 -171.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 38.0 m -150.32 123.15 8.68 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 175.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -92.78 -165.51 1.35 Allowed 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -153.14 179.03 29.87 Favored Glycine 0 N--CA 1.422 -2.253 0 C-N-CA 120.075 -1.06 . . . . 0.0 112.393 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 135.48 -160.9 24.62 Favored Glycine 0 N--CA 1.425 -2.036 0 N-CA-C 111.777 -0.529 . . . . 0.0 111.777 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -175.63 -178.41 45.43 Favored Glycine 0 C--N 1.299 -1.486 0 N-CA-C 107.379 -2.288 . . . . 0.0 107.379 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 9.9 t -126.32 174.86 8.26 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 118.605 1.202 . . . . 0.0 109.724 -177.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -166.94 168.53 40.36 Favored Glycine 0 N--CA 1.434 -1.444 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -178.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -86.08 -30.34 23.18 Favored Glycine 0 CA--C 1.502 -0.747 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 178.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 101.78 114.64 3.85 Favored Glycine 0 N--CA 1.428 -1.865 0 C-N-CA 121.02 -0.609 . . . . 0.0 112.467 177.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 8.8 m -109.26 95.66 5.78 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 153.16 -108.92 0.39 Allowed Glycine 0 N--CA 1.437 -1.269 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.13 76.22 0.48 Allowed Glycine 0 C--N 1.316 -0.541 0 O-C-N 123.678 0.281 . . . . 0.0 112.583 178.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -167.68 110.35 0.39 Allowed Glycine 0 CA--C 1.492 -1.368 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 69.7 m 66.15 121.8 0.02 OUTLIER 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.312 1.045 . . . . 0.0 111.309 -175.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.408 ' H ' HD21 ' B' ' 137' ' ' LEU . 1.8 pt? -51.82 -46.4 64.29 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -174.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -83.07 -12.72 56.88 Favored 'General case' 0 C--N 1.288 -2.087 0 O-C-N 121.308 -0.87 . . . . 0.0 112.241 -177.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 81.1 m -86.49 -59.46 2.27 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.441 178.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -162.08 113.73 1.67 Allowed 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 121.155 0.502 . . . . 0.0 111.285 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 58.0 mtm -102.92 -9.49 19.82 Favored 'General case' 0 C--O 1.188 -2.152 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.834 178.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -25.07 -60.25 0.06 Allowed 'General case' 0 N--CA 1.51 2.559 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 -168.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 5.2 p -61.27 -43.57 98.66 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 122.238 1.018 . . . . 0.0 111.128 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 45.9 mm -70.2 -38.33 74.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.837 0 CA-C-N 114.005 -1.452 . . . . 0.0 109.73 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 18.3 mm -54.7 -49.65 66.41 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.923 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.553 175.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -58.69 -65.11 0.71 Allowed 'General case' 0 N--CA 1.43 -1.442 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.308 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 65.3 m -61.97 -54.79 36.87 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -174.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -81.47 -35.59 30.34 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -174.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 9.1 tt -96.63 -34.09 11.53 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -170.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 150' ' ' MET . . . . . 0.552 ' HB2' ' OE1' ' A' ' 76' ' ' GLN . 23.1 ptt? -160.24 52.04 0.31 Allowed 'General case' 0 C--O 1.246 0.913 0 C-N-CA 117.408 -1.717 . . . . 0.0 115.247 -176.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 151' ' ' ASP . . . . . 0.473 ' CG ' ' HZ1' ' A' ' 77' ' ' LYS . 3.7 m-20 83.77 110.73 0.06 Allowed 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 116.575 2.065 . . . . 0.0 116.575 167.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.002 0 C-N-CA 125.847 1.659 . . . . 0.0 107.77 173.158 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 10.0 ptpp? . . . . . 0 N--CA 1.39 -3.466 0 CA-C-O 121.561 0.696 . . . . 0.0 110.553 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.25 -9.74 24.54 Favored Glycine 0 C--O 1.238 0.376 0 CA-C-N 114.391 -1.277 . . . . 0.0 115.158 -174.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.48 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 66.0 p-90 -68.55 -9.13 47.43 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 117.196 0.498 . . . . 0.0 112.067 178.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -58.54 -24.09 59.84 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-O 120.918 0.389 . . . . 0.0 111.797 177.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.18 -10.6 59.71 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.171 0.51 . . . . 0.0 110.406 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -105.47 10.88 33.1 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.398 0.618 . . . . 0.0 110.53 -176.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.49 HG23 HD12 ' A' ' 14' ' ' LEU . 7.5 p -139.86 128.57 27.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 p -106.66 162.09 14.06 Favored 'General case' 0 CA--C 1.473 -1.986 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.482 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 11.6 tt0 -53.63 -41.58 66.86 Favored 'General case' 0 N--CA 1.422 -1.845 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.596 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.572 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 6.2 t70 -58.69 -40.85 84.82 Favored 'General case' 0 C--O 1.203 -1.394 0 O-C-N 122.951 0.157 . . . . 0.0 111.225 178.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.49 HD12 HG23 ' A' ' 10' ' ' VAL . 3.1 tm? -69.3 -50.15 49.4 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -175.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.491 ' O ' HG23 ' A' ' 19' ' ' VAL . 13.4 ptm180 -63.79 -46.15 86.5 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.623 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.7 t -67.48 -26.66 66.48 Favored 'General case' 0 CA--C 1.556 1.186 0 CA-C-O 121.033 0.444 . . . . 0.0 110.37 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.572 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 12.3 t60 -68.1 -49.41 61.33 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.627 HD23 HD21 ' A' ' 68' ' ' LEU . 1.2 mp -60.25 -49.55 77.15 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.524 176.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.535 HG13 ' CB ' ' A' ' 47' ' ' ALA . 21.4 t -52.13 -43.3 37.82 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.765 0 C-N-CA 124.581 1.153 . . . . 0.0 109.034 177.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -58.51 -44.93 89.65 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 122.751 0.42 . . . . 0.0 110.396 177.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.557 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 2.5 mptp? -65.03 -35.57 81.58 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.576 175.271 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.453 HD21 ' HZ1' ' A' ' 71' ' ' LYS . 9.0 mp -55.5 -44.72 76.84 Favored 'General case' 0 CA--C 1.476 -1.897 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.816 176.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.63 HG11 ' HE1' ' A' ' 40' ' ' MET . 78.6 t -58.77 -47.15 90.06 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.919 0 O-C-N 124.134 0.896 . . . . 0.0 110.688 174.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -56.86 -33.76 67.14 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.986 0.422 . . . . 0.0 111.869 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.87 -45.7 15.14 Favored 'General case' 0 C--O 1.192 -1.943 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 177.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.54 HG22 ' HA ' ' A' ' 23' ' ' VAL . 3.2 tt -71.55 -35.27 55.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 O-C-N 121.105 -0.997 . . . . 0.0 110.218 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -119.2 96.88 50.32 Favored Pre-proline 0 N--CA 1.398 -3.036 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 -179.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.97 96.68 0.1 Allowed 'Trans proline' 0 C--O 1.256 1.408 0 C-N-CA 121.616 1.544 . . . . 0.0 108.444 171.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.7 t -75.81 134.8 71.64 Favored Pre-proline 0 N--CA 1.411 -2.413 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.144 -172.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -73.68 -20.97 19.6 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 122.619 2.213 . . . . 0.0 111.487 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -159.31 144.14 11.45 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 -177.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -57.52 -19.74 38.04 Favored 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 122.512 2.141 . . . . 0.0 114.091 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.43 -11.69 59.91 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 121.122 -0.986 . . . . 0.0 112.162 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.83 -8.1 56.7 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.076 0.941 . . . . 0.0 109.269 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 30.7 mt -90.12 2.1 55.67 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.864 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 36' ' ' LYS . 15.1 ptpt -133.8 23.94 3.96 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 122.448 1.118 . . . . 0.0 108.144 178.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.676 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 25.4 t70 -98.18 176.43 5.74 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 113.778 -1.556 . . . . 0.0 110.269 -175.145 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.676 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.55 -23.2 61.72 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 123.387 0.675 . . . . 0.0 111.132 178.5 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.528 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 41.9 ttm180 -72.94 -26.38 61.36 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 176.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.797 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.5 tpp -61.07 -38.62 86.87 Favored 'General case' 0 C--O 1.193 -1.87 0 CA-C-N 114.518 -1.219 . . . . 0.0 112.636 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 7.2 pt-20 -59.24 -32.07 69.65 Favored 'General case' 0 C--O 1.204 -1.295 0 C-N-CA 118.886 -1.126 . . . . 0.0 110.757 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -75.46 -46.29 33.44 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 123.839 0.855 . . . . 0.0 110.29 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 68.4 mt -63.82 -47.07 82.3 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.793 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.797 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.5 p -72.16 -28.55 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.938 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.58 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -57.06 -47.35 81.19 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 176.461 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.536 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 1.6 t80 -61.28 -47.99 83.44 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.833 174.045 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.535 ' CB ' HG13 ' A' ' 19' ' ' VAL . . . -59.52 -44.2 93.22 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.757 -176.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -62.38 -42.47 99.44 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.433 0.693 . . . . 0.0 111.314 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 55.8 pttt -69.27 -39.72 78.22 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.297 0.57 . . . . 0.0 110.635 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 49.4 t -69.5 -47.8 70.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.002 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.458 ' OE2' HD22 ' A' ' 68' ' ' LEU . 12.6 mm-40 -60.73 -37.54 82.09 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.559 178.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.87 -39.19 97.19 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.54 -0.755 . . . . 0.0 112.082 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.24 -52.84 63.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.807 0.337 . . . . 0.0 110.515 177.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.472 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -68.87 -30.15 68.6 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 179.332 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.44 -47.32 86.63 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 175.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.62 -19.15 55.98 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.298 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.0 t -79.22 -27.83 42.49 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.208 0.528 . . . . 0.0 110.176 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.76 165.29 13.01 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-O 121.627 0.727 . . . . 0.0 112.692 -175.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -116.95 18.41 14.71 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.436 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.8 p -168.45 158.54 9.72 Favored 'General case' 0 CA--C 1.49 -1.34 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 173.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HA ' ' HD1' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -71.85 -30.7 65.72 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.969 177.919 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -58.78 -47.49 84.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.111 -0.949 . . . . 0.0 108.911 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -65.86 -46.41 78.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.392 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.435 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -63.33 -45.07 92.98 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -176.837 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.434 ' HA ' ' CD2' ' A' ' 68' ' ' LEU . 7.6 t80 -63.55 -39.7 95.09 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.601 178.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -62.7 -55.86 22.94 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.472 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.4 pp -65.35 -33.14 75.27 Favored 'General case' 0 C--O 1.255 1.39 0 CA-C-O 121.598 0.713 . . . . 0.0 111.482 -175.196 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.627 HD21 HD23 ' A' ' 18' ' ' LEU . 1.4 pp -73.42 -32.41 64.4 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.909 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.527 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -68.44 -33.97 75.14 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.674 178.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -66.1 -43.16 88.05 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.403 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.508 ' NZ ' ' HB2' ' A' ' 68' ' ' LEU . 1.4 pptp? -65.17 -42.67 93.44 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 119.811 -0.756 . . . . 0.0 111.925 179.022 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.605 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.1 tt -65.94 -40.42 87.37 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.693 0 CA-C-O 121.006 0.432 . . . . 0.0 110.163 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.517 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 62.6 t80 -57.33 -52.86 63.64 Favored 'General case' 0 C--O 1.272 2.261 0 C-N-CA 124.963 1.305 . . . . 0.0 110.495 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -64.38 -33.07 75.0 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.225 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.72 -38.31 81.98 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.992 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.609 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 11.7 mt-30 -69.62 -43.86 71.84 Favored 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.626 -175.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.517 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.2 OUTLIER -70.44 -28.24 64.87 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 118.648 -1.221 . . . . 0.0 112.782 175.98 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -61.74 -49.41 76.51 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 175.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.4 pp -64.84 -40.45 95.2 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.76 -176.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.432 ' N ' HD12 ' A' ' 79' ' ' LEU . 45.9 mt-10 -62.68 -50.42 71.22 Favored 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 123.665 0.603 . . . . 0.0 112.211 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.5 pt-20 -72.57 -32.09 65.75 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 119.708 -0.797 . . . . 0.0 112.787 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.54 -35.23 80.23 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 . . . . . 0 N--CA 1.447 -0.607 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.027 178.301 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.212 -0.9 0 CA-C-O 120.619 0.247 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' B' ' 118' ' ' ASP . 51.6 tp -67.4 -41.85 84.25 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 175.099 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.8 m -65.71 -39.46 91.22 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.27 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.5 m -77.37 -20.65 54.45 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.386 0.613 . . . . 0.0 111.375 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' B' ' 115' ' ' LEU . 9.8 t70 . . . . . 0 C--N 1.317 -0.811 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 175.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 26.3 ttp . . . . . 0 C--O 1.201 -1.473 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -14.82 -71.98 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 127.22 2.208 . . . . 0.0 116.711 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 20.2 m -70.5 -38.8 74.36 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 122.01 -0.432 . . . . 0.0 111.623 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 66.8 mt -66.88 -45.95 86.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.406 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 14.7 tt -66.04 -37.21 79.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.349 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -61.29 -52.84 63.02 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.6 t -68.63 -54.06 18.74 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -176.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -80.96 -37.4 29.46 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -173.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.527 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 52.7 tp . . . . . 0 N--CA 1.471 0.608 0 CA-C-N 118.205 0.457 . . . . 0.0 109.932 178.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.513 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 39.1 mttp . . . . . 0 N--CA 1.433 -1.322 0 CA-C-O 120.86 0.362 . . . . 0.0 110.061 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -67.22 -17.42 68.13 Favored Glycine 0 C--N 1.317 -0.495 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.497 -176.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.513 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 63.1 p-90 -68.19 -10.25 52.96 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.48 -17.61 59.96 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -81.67 -9.46 59.65 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 121.162 0.506 . . . . 0.0 109.989 177.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.434 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 53.5 m-70 -101.63 9.66 40.9 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.91 -178.083 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.6 p -140.05 110.86 4.19 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.732 0 CA-C-O 122.24 1.019 . . . . 0.0 109.429 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 m -88.38 161.29 17.17 Favored 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.095 -0.957 . . . . 0.0 108.705 -176.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -54.56 -36.9 64.83 Favored 'General case' 0 C--O 1.195 -1.81 0 C-N-CA 122.891 0.477 . . . . 0.0 110.17 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -52.09 -46.43 65.22 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 123.919 0.888 . . . . 0.0 113.134 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.505 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -70.19 -50.64 38.08 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -174.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.543 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.1 ptm180 -64.17 -44.65 91.42 Favored 'General case' 0 N--CA 1.421 -1.891 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.12 -177.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.0 t -63.66 -30.48 71.58 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 122.966 0.507 . . . . 0.0 110.546 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -65.31 -47.22 77.35 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.817 HD23 HD21 ' A' ' 68' ' ' LEU . 5.4 mp -65.61 -40.92 93.15 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.476 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.2 t -58.84 -46.4 91.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 124.636 1.174 . . . . 0.0 110.166 176.092 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -57.32 -51.91 67.49 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.326 177.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.2 mttp -62.26 -40.33 95.83 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.692 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.523 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -51.84 -52.61 48.1 Favored 'General case' 0 CA--C 1.508 -0.667 0 C-N-CA 124.401 1.08 . . . . 0.0 108.922 176.945 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.467 HG13 ' HB3' ' A' ' 43' ' ' LEU . 39.4 t -54.1 -51.22 48.8 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.207 0 O-C-N 124.308 1.005 . . . . 0.0 110.752 176.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -56.92 -34.57 68.08 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -176.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.37 -46.76 14.19 Favored 'General case' 0 C--O 1.195 -1.795 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.74 177.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.616 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.84 -26.49 17.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 CA-C-O 122.063 0.935 . . . . 0.0 110.95 -174.073 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.616 ' CD2' HG23 ' A' ' 26' ' ' ILE . 69.4 m-85 -124.94 91.66 49.0 Favored Pre-proline 0 C--N 1.283 -2.305 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.129 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -65.68 102.02 0.49 Allowed 'Trans proline' 0 C--O 1.247 0.943 0 C-N-CA 122.134 1.89 . . . . 0.0 111.001 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.451 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 12.7 t -77.23 136.99 64.83 Favored Pre-proline 0 N--CA 1.423 -1.792 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.227 -176.326 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -76.5 -27.49 7.63 Favored 'Trans proline' 0 C--O 1.244 0.783 0 C-N-CA 122.974 2.449 . . . . 0.0 112.154 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -147.52 149.19 33.42 Favored Pre-proline 0 CA--C 1.485 -1.528 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.29 -9.91 26.85 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 121.626 1.551 . . . . 0.0 111.702 177.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.24 -10.44 57.69 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.15 0.5 . . . . 0.0 111.522 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.451 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -81.11 -6.56 58.97 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.936 0.874 . . . . 0.0 109.025 176.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.553 ' HA ' ' HE3' ' A' ' 40' ' ' MET . 21.8 mt -90.85 5.55 48.03 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.366 -178.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -133.48 17.71 3.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.107 0.956 . . . . 0.0 108.926 177.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.656 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 15.3 t70 -88.54 176.69 7.04 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.974 -176.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.656 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.8 OUTLIER -71.29 -26.72 62.99 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 173.915 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.584 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 32.2 ttm180 -59.4 -36.05 75.11 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.933 -1.03 . . . . 0.0 109.391 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.553 ' HE3' ' HA ' ' A' ' 35' ' ' LEU . 8.6 tpp -58.75 -37.89 77.22 Favored 'General case' 0 C--O 1.212 -0.905 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.869 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -66.76 -27.83 67.92 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 117.947 -1.501 . . . . 0.0 110.072 -178.786 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -75.03 -42.06 57.97 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.522 0.729 . . . . 0.0 110.208 176.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.589 HD22 ' CG ' ' A' ' 27' ' ' PHE . 28.3 mt -61.92 -53.57 53.95 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.878 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.416 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.0 p -70.22 -27.79 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.597 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.267 -178.154 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.67 84.96 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.938 0.399 . . . . 0.0 110.199 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.54 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -60.29 -44.7 95.16 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.889 175.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.3 -41.93 97.82 Favored 'General case' 0 C--O 1.199 -1.58 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.485 -177.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.5 mttm -64.65 -44.22 91.14 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 176.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 58.2 pttt -63.8 -40.55 96.92 Favored 'General case' 0 C--O 1.256 1.424 0 CA-C-O 121.544 0.688 . . . . 0.0 110.373 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.457 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 48.7 t -70.74 -45.32 74.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 114.933 -1.031 . . . . 0.0 110.694 178.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.408 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.9 tm-20 -56.98 -46.2 82.41 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.446 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.75 -37.05 92.95 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.624 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -61.04 -52.98 62.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.012 0.434 . . . . 0.0 110.592 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.554 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -69.85 -27.75 65.1 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 179.04 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -62.83 -49.5 74.67 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 175.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -74.5 -19.51 60.34 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.7 t -79.65 -20.08 47.58 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 120.717 0.294 . . . . 0.0 110.78 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.52 161.67 13.55 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -174.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -107.86 5.6 26.6 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.47 -1.241 . . . . 0.0 110.53 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 75.5 p -164.02 159.51 20.74 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.434 ' NE ' ' HB3' ' A' ' 9' ' ' HIS . 0.2 OUTLIER -72.51 -24.07 61.1 Favored 'General case' 0 C--O 1.197 -1.677 0 C-N-CA 118.91 -1.116 . . . . 0.0 109.818 177.746 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -66.02 -44.46 84.63 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -66.3 -46.34 77.29 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.282 175.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.409 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.1 -45.36 89.01 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 123.157 0.286 . . . . 0.0 110.54 -177.474 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -44.09 95.0 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 123.762 0.664 . . . . 0.0 110.566 177.027 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.42 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 15.4 t-80 -64.75 -50.98 64.74 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.0 pp -67.3 -32.2 73.03 Favored 'General case' 0 C--O 1.252 1.198 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.218 -174.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.817 HD21 HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -75.95 -31.48 59.08 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 178.268 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.491 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -64.51 -35.28 80.45 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.798 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 12.6 mt-10 -72.17 -40.55 67.89 Favored 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 120.304 -0.558 . . . . 0.0 109.985 179.051 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.75 -38.87 87.5 Favored 'General case' 0 C--O 1.212 -0.894 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.667 -179.103 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.623 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -68.69 -42.94 83.39 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.291 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -57.22 -51.75 68.07 Favored 'General case' 0 C--O 1.275 2.432 0 C-N-CA 124.64 1.176 . . . . 0.0 110.793 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.9 -36.9 85.87 Favored 'General case' 0 C--O 1.21 -0.988 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.674 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.3 mp -61.36 -39.82 84.06 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 O-C-N 123.451 0.469 . . . . 0.0 110.182 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.623 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 10.8 mt-30 -64.18 -49.9 70.23 Favored 'General case' 0 CA--C 1.496 -1.1 0 O-C-N 123.636 0.585 . . . . 0.0 110.286 -177.462 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.451 ' H ' ' HG2' ' A' ' 77' ' ' LYS . 0.8 OUTLIER -73.28 -28.22 61.99 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 118.786 -1.166 . . . . 0.0 113.922 179.377 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -64.58 -47.79 77.38 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.0 pp -64.93 -38.99 92.8 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.58 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 52.4 mt-10 -58.49 -54.45 46.94 Favored 'General case' 0 CA--C 1.49 -1.332 0 O-C-N 123.992 0.807 . . . . 0.0 110.302 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 10.6 pt-20 -68.39 -39.05 81.86 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 120.312 -0.555 . . . . 0.0 112.127 -175.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.456 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -66.13 -34.17 77.45 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.687 -178.828 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 . . . . . 0 C--N 1.314 -0.97 0 CA-C-O 121.279 0.562 . . . . 0.0 110.095 177.993 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.2 mm? . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 33.5 tp -65.38 -45.87 82.35 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 122.208 -0.307 . . . . 0.0 110.379 175.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 28.7 m -66.65 -39.74 88.36 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.149 0.5 . . . . 0.0 110.332 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 30.3 m -73.19 -22.5 60.45 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.426 0.631 . . . . 0.0 111.944 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 40.1 t0 . . . . . 0 C--N 1.313 -1.004 0 CA-C-O 122.106 0.955 . . . . 0.0 108.614 174.287 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 45.3 ttp . . . . . 0 C--O 1.21 -0.986 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -35.94 -65.96 0.23 Allowed 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.0 p -66.12 -33.92 76.88 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 121.243 0.544 . . . . 0.0 112.103 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 51.2 mm -67.0 -49.59 72.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.975 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.448 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 21.2 tt -69.7 -31.19 47.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.163 -177.276 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -57.81 -65.31 0.66 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 20.0 p -67.2 -45.6 76.38 Favored 'General case' 0 C--O 1.247 0.96 0 CA-C-N 114.441 -1.254 . . . . 0.0 113.517 -174.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -80.44 -34.41 36.09 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.491 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 9.1 tt . . . . . 0 C--N 1.313 -0.997 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -170.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.468 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 76.9 mttt . . . . . 0 N--CA 1.421 -1.89 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.01 -21.39 31.03 Favored Glycine 0 C--N 1.321 -0.252 0 CA-C-N 115.243 -0.89 . . . . 0.0 114.947 -176.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.468 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 55.7 p-90 -64.13 -14.69 56.69 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 117.365 0.583 . . . . 0.0 112.368 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -61.29 -12.88 15.21 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 176.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -81.76 -16.85 49.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.66 0.743 . . . . 0.0 109.833 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -105.32 18.69 21.86 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.825 -171.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.67 130.32 9.67 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.831 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.2 m -105.28 162.88 13.04 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 -177.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -58.15 -36.26 72.72 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 120.792 0.329 . . . . 0.0 110.406 177.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -58.41 -41.33 84.72 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.828 -0.623 . . . . 0.0 112.123 178.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.54 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -68.3 -52.06 37.89 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 -175.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.575 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.4 ptm180 -63.97 -43.84 94.56 Favored 'General case' 0 N--CA 1.415 -2.2 0 CA-C-N 114.301 -1.318 . . . . 0.0 112.849 -176.389 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 t -66.71 -28.3 68.32 Favored 'General case' 0 N--CA 1.44 -0.962 0 N-CA-C 110.237 -0.282 . . . . 0.0 110.237 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.7 t60 -68.02 -41.98 81.35 Favored 'General case' 0 C--O 1.241 0.644 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.78 HD23 HD21 ' A' ' 68' ' ' LEU . 5.0 mp -67.02 -40.67 87.29 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.173 -0.922 . . . . 0.0 109.704 177.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 15' ' ' ARG . 76.6 t -56.85 -47.9 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.049 0.94 . . . . 0.0 109.793 174.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.483 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 23.1 t-80 -54.85 -52.23 63.41 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.367 177.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.4 mttp -61.77 -39.76 92.8 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.428 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.479 ' O ' HG22 ' A' ' 26' ' ' ILE . 8.8 mt -52.37 -52.55 52.89 Favored 'General case' 0 CA--C 1.506 -0.748 0 C-N-CA 123.463 0.705 . . . . 0.0 111.0 175.37 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.2 t -54.92 -48.7 74.51 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.373 0 O-C-N 124.0 0.812 . . . . 0.0 109.869 176.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 40.2 mt-30 -57.55 -34.65 69.38 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -175.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.15 -45.54 15.0 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 176.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.531 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.6 -23.42 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 121.988 0.899 . . . . 0.0 110.439 -174.936 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD2' HG23 ' A' ' 26' ' ' ILE . 66.1 m-85 -133.2 84.62 47.22 Favored Pre-proline 0 C--N 1.284 -2.242 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.18 106.46 0.3 Allowed 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.636 2.224 . . . . 0.0 111.194 -177.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.408 HG21 HD21 ' A' ' 35' ' ' LEU . 7.4 t -83.73 137.16 41.34 Favored Pre-proline 0 N--CA 1.425 -1.709 0 CA-C-O 121.124 0.488 . . . . 0.0 111.625 -172.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -80.74 -19.93 8.21 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.787 2.325 . . . . 0.0 112.315 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -158.53 159.06 29.93 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.705 -176.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.568 ' HA ' HD12 ' A' ' 35' ' ' LEU . 58.6 Cg_endo -77.17 -1.46 11.63 Favored 'Trans proline' 0 N--CA 1.442 -1.504 0 C-N-CA 121.446 1.431 . . . . 0.0 113.876 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -95.34 -17.12 21.87 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.692 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.9 -16.05 63.66 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 122.189 0.995 . . . . 0.0 108.845 172.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 32' ' ' PRO . 33.3 mt -87.36 1.23 53.92 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.276 -1.329 . . . . 0.0 111.374 -179.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -133.04 24.16 4.22 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-O 122.407 1.099 . . . . 0.0 108.888 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.58 ' O ' ' HB3' ' A' ' 40' ' ' MET . 25.6 t70 -82.36 170.92 14.78 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 114.053 -1.43 . . . . 0.0 108.151 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.552 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.81 -25.5 62.89 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-O 121.903 0.859 . . . . 0.0 109.743 179.115 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.541 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 21.4 ttp180 -77.4 -15.78 59.18 Favored 'General case' 0 C--O 1.251 1.139 0 C-N-CA 124.442 1.097 . . . . 0.0 110.204 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.615 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.5 tpp -59.55 -32.94 70.8 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.068 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HA ' HG12 ' A' ' 44' ' ' VAL . 0.5 OUTLIER -62.32 -33.55 74.91 Favored 'General case' 0 C--O 1.184 -2.349 0 C-N-CA 119.003 -1.079 . . . . 0.0 110.595 -179.771 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -70.99 -46.14 62.79 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 121.266 0.555 . . . . 0.0 109.556 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 18.7 mt -59.36 -51.09 71.4 Favored 'General case' 0 C--O 1.245 0.868 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.11 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.615 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -72.86 -28.59 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.058 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.728 -177.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.37 -46.42 90.25 Favored 'General case' 0 C--O 1.246 0.896 0 N-CA-C 109.794 -0.446 . . . . 0.0 109.794 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.5 t80 -59.58 -47.04 87.12 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.773 173.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.78 -41.63 95.95 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.771 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -63.02 -46.27 88.37 Favored 'General case' 0 C--O 1.216 -0.676 0 O-C-N 123.46 0.475 . . . . 0.0 111.613 176.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.4 pttp -64.37 -38.81 92.36 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-O 121.631 0.729 . . . . 0.0 110.885 -176.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.427 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 51.7 t -72.1 -45.26 63.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.551 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.433 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.8 tm-20 -57.07 -45.33 83.36 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 177.106 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.02 -40.06 95.05 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.273 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -61.12 -52.93 62.82 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.173 0.511 . . . . 0.0 111.195 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.437 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -67.4 -30.35 70.1 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 178.475 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -63.06 -53.76 48.73 Favored 'General case' 0 C--O 1.196 -1.759 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -73.04 -20.97 60.88 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 122.048 -0.407 . . . . 0.0 111.463 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.8 t -77.67 -42.49 34.47 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.2 162.39 28.46 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -173.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -102.89 4.53 37.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.147 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.421 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 66.7 p -160.17 160.04 32.39 Favored 'General case' 0 CA--C 1.488 -1.439 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.07 -24.26 61.48 Favored 'General case' 0 C--O 1.206 -1.215 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.152 176.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -68.07 -47.81 67.27 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -61.45 -43.92 98.02 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.462 176.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -48.38 77.03 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 123.36 0.412 . . . . 0.0 110.389 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.528 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 0.3 OUTLIER -60.58 -45.93 92.11 Favored 'General case' 0 N--CA 1.433 -1.311 0 O-C-N 123.882 0.739 . . . . 0.0 110.32 177.785 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.654 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 20.4 m80 -67.41 -42.74 82.78 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -178.038 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.437 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.0 pp -71.27 -31.63 67.72 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.56 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.78 HD21 HD23 ' A' ' 18' ' ' LEU . 1.7 pp -73.83 -32.85 63.88 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 178.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.484 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.83 -37.31 87.18 Favored 'General case' 0 C--O 1.197 -1.703 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.225 175.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.654 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 69.9 mm-40 -64.16 -43.89 93.76 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-O 121.824 0.821 . . . . 0.0 110.25 177.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -69.88 -41.05 75.28 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.4 -177.469 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.501 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.8 tt -68.5 -34.66 66.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.43 0.634 . . . . 0.0 109.467 -178.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.581 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 39.1 t80 -57.49 -54.4 47.26 Favored 'General case' 0 C--O 1.261 1.682 0 C-N-CA 125.8 1.64 . . . . 0.0 109.318 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.2 ptpt -64.75 -33.84 76.93 Favored 'General case' 0 C--O 1.207 -1.157 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.376 -178.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.436 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -63.61 -38.8 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-O 120.652 0.263 . . . . 0.0 110.858 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.552 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 37.6 mt-30 -69.07 -44.36 72.73 Favored 'General case' 0 CA--C 1.501 -0.942 0 C-N-CA 120.535 -0.466 . . . . 0.0 111.294 -177.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.581 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -72.15 -28.19 63.08 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 118.42 -1.312 . . . . 0.0 112.005 177.453 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.86 -49.04 77.85 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 176.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.65 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -64.15 -42.3 96.81 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.879 -178.25 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.55 -45.13 95.46 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -75.39 -32.72 60.87 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.837 -0.745 . . . . 0.0 111.936 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.85 -38.26 88.4 Favored 'General case' 0 C--N 1.348 0.504 0 CA-C-O 121.01 0.433 . . . . 0.0 110.133 -178.852 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.44 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 48.3 ttp180 . . . . . 0 N--CA 1.427 -1.617 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.608 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.65 HD21 ' HB3' ' A' ' 79' ' ' LEU . 26.5 tp . . . . . 0 N--CA 1.434 -1.24 0 CA-C-O 120.546 0.212 . . . . 0.0 111.388 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 63.3 tp -70.45 -41.67 72.52 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 172.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.6 m -72.24 -42.58 65.51 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.954 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.8 m -62.27 -34.6 76.88 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.245 0.545 . . . . 0.0 110.489 176.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 13.8 t70 . . . . . 0 N--CA 1.471 0.575 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 23.5 ptt? . . . . . 0 N--CA 1.445 -0.679 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.469 ' HA ' ' CG2' ' B' ' 145' ' ' ILE 0.339 38.6 mt-10 -37.19 -47.16 0.76 Allowed 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -168.012 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.6 m -64.26 -52.42 58.78 Favored 'General case' 0 C--O 1.267 1.991 0 CA-C-O 121.705 0.764 . . . . 0.0 110.169 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 46.3 mm -64.53 -51.54 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.098 -176.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.528 ' HA ' ' OH ' ' A' ' 65' ' ' TYR . 10.7 tt -58.76 -43.74 88.63 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.688 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.747 -177.424 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -61.59 -45.7 93.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.264 0.078 . . . . 0.0 110.852 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 20.8 p -66.54 -32.24 73.47 Favored 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -80.73 -31.36 36.06 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.283 0.563 . . . . 0.0 110.308 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 12.8 tp . . . . . 0 C--N 1.311 -1.106 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.673 -175.944 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HD3' ' NE1' ' A' ' 6' ' ' TRP . 14.3 ptpt . . . . . 0 N--CA 1.416 -2.171 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.94 -25.9 32.26 Favored Glycine 0 C--O 1.239 0.439 0 CA-C-N 114.783 -1.099 . . . . 0.0 115.11 -172.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.48 ' NE1' ' HD3' ' A' ' 4' ' ' LYS . 67.3 p-90 -66.72 -4.66 9.48 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -64.47 -21.44 66.66 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.07 0.462 . . . . 0.0 111.081 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -89.33 0.14 57.03 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.776 0.798 . . . . 0.0 110.065 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -106.4 6.53 30.46 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.388 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.42 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.3 p -136.02 111.08 11.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 CA-C-N 115.312 -0.858 . . . . 0.0 108.955 -178.315 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 m -81.72 152.85 26.84 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.834 -175.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -56.29 -37.96 70.58 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.309 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -63.57 -33.88 76.57 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.537 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.0 tm? -70.6 -52.25 22.72 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -176.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.551 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -65.03 -42.73 94.09 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.843 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.7 t -63.99 -31.26 72.38 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 178.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.538 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 31.0 t60 -69.66 -40.19 76.59 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.204 0.526 . . . . 0.0 109.714 178.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.703 HD23 HD21 ' A' ' 68' ' ' LEU . 5.5 mp -65.57 -41.34 93.04 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.997 176.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 15' ' ' ARG . 69.8 t -57.13 -49.04 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 123.822 0.849 . . . . 0.0 109.628 174.394 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -52.28 -52.4 52.98 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.869 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 58.0 mttm -63.79 -41.06 98.0 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.805 178.514 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.536 ' O ' HG22 ' A' ' 26' ' ' ILE . 15.1 mt -50.7 -51.94 44.91 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 123.966 0.791 . . . . 0.0 109.949 176.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.719 HG11 ' HE1' ' A' ' 40' ' ' MET . 72.5 t -56.89 -51.04 73.12 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.697 0 O-C-N 124.206 0.941 . . . . 0.0 111.423 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -54.02 -37.64 64.3 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.508 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -82.17 -46.65 13.5 Favored 'General case' 0 C--O 1.21 -0.997 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 177.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.556 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.51 -22.21 16.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.66 0 CA-C-O 122.051 0.929 . . . . 0.0 110.102 -174.345 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.576 ' CG ' HD22 ' A' ' 43' ' ' LEU . 58.4 m-85 -130.58 84.1 60.08 Favored Pre-proline 0 C--N 1.275 -2.652 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.631 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.415 ' HG2' ' HA ' ' B' ' 118' ' ' ASP . 19.8 Cg_endo -59.25 107.01 0.33 Allowed 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.865 1.71 . . . . 0.0 109.874 179.027 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.2 t -84.42 149.08 54.1 Favored Pre-proline 0 C--N 1.29 -1.993 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.055 -174.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.56 -28.61 14.19 Favored 'Trans proline' 0 C--O 1.243 0.737 0 C-N-CA 122.404 2.069 . . . . 0.0 111.427 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -155.7 161.06 30.27 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.243 -177.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 35' ' ' LEU . 57.0 Cg_endo -78.72 -3.5 13.33 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 121.931 1.754 . . . . 0.0 114.623 -177.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.55 ' O ' ' HG2' ' A' ' 36' ' ' LYS . . . -96.89 -16.97 20.45 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.245 0.545 . . . . 0.0 109.868 177.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.621 ' HA ' ' OD2' ' A' ' 37' ' ' ASP . . . -66.06 -17.02 64.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 122.466 1.127 . . . . 0.0 108.828 173.195 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 32' ' ' PRO . 55.8 mt -80.81 5.42 16.02 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 113.458 -1.701 . . . . 0.0 111.056 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 15.6 ptpt -133.82 6.19 3.69 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.179 0.514 . . . . 0.0 110.722 173.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.621 ' OD2' ' HA ' ' A' ' 34' ' ' ALA . 69.6 m-20 -85.25 179.71 7.16 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.826 178.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.488 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.4 OUTLIER -59.18 -24.83 63.41 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.307 0.643 . . . . 0.0 111.836 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.638 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 22.6 tpp180 -65.27 -35.65 81.69 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.092 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.848 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.1 tpp -59.59 -35.07 73.59 Favored 'General case' 0 C--O 1.191 -1.986 0 CA-C-N 114.715 -1.129 . . . . 0.0 112.693 -177.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 13.9 pt-20 -60.92 -32.92 72.39 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.475 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -78.57 -43.89 25.48 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.18 0.514 . . . . 0.0 110.133 178.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 16.5 mt -60.77 -50.95 71.4 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.583 -178.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.848 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.5 p -68.84 -32.95 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.59 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.049 -179.015 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.13 -46.42 82.68 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-O 120.759 0.314 . . . . 0.0 110.552 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.8 t80 -61.67 -46.75 88.4 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.044 174.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.73 -37.84 88.16 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 120.319 -0.553 . . . . 0.0 111.543 -176.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 91.8 mttt -66.74 -43.1 85.09 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 123.232 0.613 . . . . 0.0 111.501 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.9 pttp -67.27 -37.29 83.2 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.549 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 37.3 t -71.26 -48.0 56.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.603 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.3 tm-20 -57.55 -48.25 79.81 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 123.428 0.691 . . . . 0.0 109.584 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.41 -35.17 91.31 Favored Glycine 0 C--N 1.332 0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.308 178.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -63.52 -52.51 60.89 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 122.729 0.412 . . . . 0.0 110.273 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.461 ' H ' ' HG2' ' A' ' 54' ' ' MET . 0.0 OUTLIER -67.86 -30.61 70.03 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 177.883 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -62.6 -41.48 99.0 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 175.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -78.81 -21.84 47.11 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.862 178.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.5 t -84.48 -29.46 26.01 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-O 121.164 0.507 . . . . 0.0 110.869 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.95 166.67 13.77 Favored 'General case' 0 C--O 1.245 0.84 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -176.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -116.72 6.93 13.35 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.416 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.6 p -157.99 158.34 34.71 Favored 'General case' 0 CA--C 1.475 -1.918 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 173.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.42 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.4 -26.21 61.79 Favored 'General case' 0 C--O 1.2 -1.522 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.926 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -66.18 -45.08 82.13 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -62.14 -46.78 87.49 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.15 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.41 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -65.28 -47.4 76.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.816 -0.175 . . . . 0.0 110.928 -177.335 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -58.96 -46.09 88.9 Favored 'General case' 0 C--O 1.208 -1.11 0 C-N-CA 123.459 0.704 . . . . 0.0 110.091 176.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -64.28 -49.61 71.15 Favored 'General case' 0 C--O 1.213 -0.84 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.445 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.3 pp -68.09 -32.51 72.87 Favored 'General case' 0 C--O 1.255 1.395 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.609 -176.626 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.703 HD21 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -74.47 -35.05 63.27 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.506 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -62.8 -37.46 86.79 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.535 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -64.3 -44.51 91.4 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.954 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -42.23 79.33 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.859 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 7.0 tt -63.49 -44.14 98.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.564 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.444 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 35.7 t80 -55.3 -54.19 46.69 Favored 'General case' 0 C--O 1.259 1.582 0 C-N-CA 124.97 1.308 . . . . 0.0 110.035 -179.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -65.12 -32.02 73.51 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.597 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -67.77 -40.94 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 122.96 0.504 . . . . 0.0 111.189 178.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.542 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 43.2 mt-30 -66.21 -39.56 89.71 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.379 0.609 . . . . 0.0 109.425 -179.287 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.679 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS 0.267 0.0 OUTLIER -71.86 -27.21 62.72 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 174.134 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.514 ' OE1' HD23 ' B' ' 114' ' ' LEU . 2.2 tm-20 -64.9 -52.21 57.71 Favored 'General case' 0 C--N 1.309 -1.196 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.455 ' HA ' ' CG ' ' A' ' 82' ' ' LYS . 4.7 pp -62.16 -37.03 83.64 Favored 'General case' 0 C--O 1.248 1.015 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.142 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.599 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 12.9 pt-20 -65.93 -44.89 83.76 Favored 'General case' 0 N--CA 1.439 -1.0 0 C-N-CA 119.791 -0.763 . . . . 0.0 110.606 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -70.61 -43.34 69.5 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.54 -177.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.455 ' CG ' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -62.19 -46.35 89.31 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -177.255 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 25.5 ttm180 . . . . . 0 N--CA 1.429 -1.5 0 O-C-N 123.359 0.412 . . . . 0.0 110.594 -177.799 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.514 HD23 ' OE1' ' A' ' 78' ' ' GLU . 26.6 tp . . . . . 0 C--O 1.183 -2.433 0 CA-C-O 119.345 -0.36 . . . . 0.0 111.563 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 35.8 tp -70.96 -36.05 72.41 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-N 118.926 0.785 . . . . 0.0 109.995 175.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 31.5 m -64.93 -36.13 83.4 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 16.1 m -76.66 -36.3 57.42 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.972 176.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.415 ' HA ' ' HG2' ' A' ' 28' ' ' PRO . 29.5 t70 . . . . . 0 C--N 1.315 -0.911 0 C-N-CA 125.327 1.451 . . . . 0.0 110.491 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 24.4 ptp . . . . . 0 C--O 1.197 -1.661 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.435 ' H ' ' CD ' ' B' ' 142' ' ' GLU . 1.1 mp0 -17.98 -70.28 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 127.524 2.33 . . . . 0.0 115.84 -172.528 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 50.1 m -72.94 -38.66 66.73 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 120.94 0.4 . . . . 0.0 111.373 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 78.9 mt -65.97 -53.4 38.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.196 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 19.8 tt -65.55 -31.69 54.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.139 -177.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -59.93 -51.22 70.62 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.8 p -69.41 -39.33 77.99 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -80.95 -52.91 6.92 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.506 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 7.3 tt . . . . . 0 C--N 1.303 -1.437 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.869 -171.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.6 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 15.6 ptpt . . . . . 0 N--CA 1.422 -1.85 0 CA-C-O 121.98 0.895 . . . . 0.0 111.883 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.19 -2.97 10.24 Favored Glycine 0 CA--C 1.508 -0.355 0 CA-C-N 114.197 -1.365 . . . . 0.0 114.907 -175.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.6 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 63.7 p-90 -68.35 -11.83 60.17 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 117.391 0.595 . . . . 0.0 110.771 176.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -60.75 -25.15 66.28 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.237 0.541 . . . . 0.0 110.345 176.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -77.69 -4.51 46.49 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 121.141 0.496 . . . . 0.0 110.64 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.7 m-70 -111.61 10.6 21.15 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 121.167 0.508 . . . . 0.0 110.664 -177.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.7 p -138.71 110.39 5.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 CA-C-O 122.043 0.925 . . . . 0.0 109.261 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.9 m -81.3 156.23 25.63 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.031 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.7 tm0? -52.0 -37.96 55.09 Favored 'General case' 0 C--O 1.204 -1.338 0 C-N-CA 124.23 1.012 . . . . 0.0 110.509 176.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -60.54 -38.42 84.43 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.542 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -69.87 -50.0 46.8 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 -176.254 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.571 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.9 OUTLIER -65.23 -46.39 80.81 Favored 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 114.362 -1.29 . . . . 0.0 112.888 -177.894 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.8 t -66.4 -26.7 67.37 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.015 0.436 . . . . 0.0 110.03 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.438 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 10.2 t60 -64.8 -49.81 69.23 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 176.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.738 HD23 HD21 ' A' ' 68' ' ' LEU . 4.5 mp -63.7 -39.46 94.37 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.197 177.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 15' ' ' ARG . 65.8 t -58.35 -51.85 66.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 124.077 0.951 . . . . 0.0 110.897 175.35 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -54.28 -45.42 72.47 Favored 'General case' 0 C--O 1.254 1.303 0 C-N-CA 123.705 0.802 . . . . 0.0 110.482 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -66.78 -39.56 87.85 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.901 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.486 ' O ' HG22 ' A' ' 26' ' ' ILE . 30.1 mt -51.14 -50.58 58.62 Favored 'General case' 0 CA--C 1.5 -0.977 0 O-C-N 123.76 0.663 . . . . 0.0 109.963 175.065 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.541 HG13 ' HB3' ' A' ' 43' ' ' LEU . 73.8 t -54.19 -53.47 28.79 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.89 0 O-C-N 124.285 0.99 . . . . 0.0 110.353 176.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -51.91 -37.41 52.41 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -178.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.16 -46.31 13.95 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 178.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.486 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -75.92 -21.97 15.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.856 0.836 . . . . 0.0 110.422 -174.256 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.481 ' CD2' HG23 ' A' ' 26' ' ' ILE . 42.2 m-85 -133.98 89.72 28.51 Favored Pre-proline 0 N--CA 1.412 -2.333 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.412 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -59.76 100.47 0.14 Allowed 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.019 1.813 . . . . 0.0 110.383 176.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -67.84 138.04 92.79 Favored Pre-proline 0 N--CA 1.428 -1.545 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.762 -172.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.34 -30.38 63.29 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.825 2.35 . . . . 0.0 111.832 178.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -161.79 150.03 12.46 Favored Pre-proline 0 CA--C 1.503 -0.838 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 -176.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.434 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 7.6 Cg_endo -54.73 -25.05 40.44 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 122.579 2.186 . . . . 0.0 113.717 174.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.96 -11.72 59.84 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 121.21 -0.931 . . . . 0.0 112.029 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.69 -9.38 59.8 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.761 0.791 . . . . 0.0 109.258 177.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.434 ' CD1' ' HA ' ' A' ' 32' ' ' PRO . 22.6 mt -87.84 -0.07 56.48 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.711 -178.272 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.411 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -133.86 15.3 3.94 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.967 0.889 . . . . 0.0 110.205 178.027 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.644 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 30.9 t70 -94.25 179.73 5.21 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.16 -178.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.644 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.7 -25.15 62.83 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 120.591 0.234 . . . . 0.0 110.75 177.959 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.642 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 15.4 tpp180 -57.87 -34.65 69.98 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 174.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.749 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.7 tpp -60.38 -36.98 79.35 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-N 114.613 -1.176 . . . . 0.0 113.133 -178.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.8 pt-20 -62.65 -31.43 72.3 Favored 'General case' 0 C--O 1.202 -1.431 0 C-N-CA 118.528 -1.269 . . . . 0.0 110.165 -177.196 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -74.23 -47.42 35.35 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-O 121.77 0.795 . . . . 0.0 110.099 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 20.4 mt -63.54 -46.46 85.89 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.704 -177.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.749 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.2 p -71.86 -27.86 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.534 -178.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.9 -47.6 84.41 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.55 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.9 t80 -60.09 -46.26 90.18 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.23 173.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.15 97.83 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.367 -176.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -65.09 -39.36 93.07 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 123.603 0.761 . . . . 0.0 111.629 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.7 pttp -70.96 -38.54 72.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.527 0.68 . . . . 0.0 109.923 -177.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.485 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 42.8 t -73.66 -43.2 54.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.915 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.416 ' HG3' HG23 ' A' ' 19' ' ' VAL . 11.0 tm-20 -59.44 -45.3 91.98 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.88 -41.37 94.14 Favored Glycine 0 C--O 1.221 -0.696 0 O-C-N 123.663 0.602 . . . . 0.0 112.281 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.9 -54.34 48.06 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.104 0.562 . . . . 0.0 111.195 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.482 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -67.24 -34.13 76.81 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.673 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -62.37 -43.37 98.98 Favored 'General case' 0 C--O 1.2 -1.521 0 C-N-CA 123.754 0.822 . . . . 0.0 109.083 176.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -81.6 -15.29 55.17 Favored 'General case' 0 C--N 1.311 -1.076 0 O-C-N 121.414 -0.804 . . . . 0.0 112.035 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.5 t -85.43 -44.37 12.8 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 122.264 -0.273 . . . . 0.0 111.716 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.94 163.63 24.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 -175.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -105.59 -2.42 23.52 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.686 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.2 m -153.5 157.71 40.23 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.483 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -71.8 -34.75 69.62 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 119.885 -0.726 . . . . 0.0 111.113 177.774 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -62.06 -39.28 91.86 Favored 'General case' 0 C--O 1.205 -1.245 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -65.35 -48.48 72.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.535 177.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -44.96 92.35 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 123.434 0.459 . . . . 0.0 110.197 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -60.53 -44.76 95.72 Favored 'General case' 0 C--O 1.208 -1.088 0 O-C-N 123.829 0.706 . . . . 0.0 110.249 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -58.8 -55.78 30.64 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.326 0.65 . . . . 0.0 111.03 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.482 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.5 pp -67.4 -33.72 75.76 Favored 'General case' 0 C--O 1.249 1.061 0 CA-C-O 121.058 0.456 . . . . 0.0 112.096 -175.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.738 HD21 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -74.98 -32.39 61.67 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.471 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.44 -39.54 94.75 Favored 'General case' 0 C--O 1.21 -1.001 0 CA-C-N 115.296 -0.866 . . . . 0.0 109.573 176.269 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -63.43 -46.22 87.32 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.903 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.492 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.01 -40.75 78.51 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.746 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.524 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -65.13 -44.83 95.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.285 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -56.54 -49.59 74.35 Favored 'General case' 0 C--O 1.264 1.817 0 C-N-CA 124.823 1.249 . . . . 0.0 110.876 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -66.76 -33.25 75.21 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.898 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.492 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -64.29 -39.58 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 176.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.524 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 34.0 mt-30 -63.15 -46.03 89.12 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.294 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.591 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -68.83 -31.04 69.74 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 118.901 -1.12 . . . . 0.0 113.507 177.995 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.5 tp10 -61.2 -52.33 65.26 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.509 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -61.46 -43.59 98.6 Favored 'General case' 0 C--O 1.243 0.734 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -177.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.499 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 11.4 pt-20 -69.7 -44.03 71.22 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 119.697 -0.801 . . . . 0.0 112.358 -177.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -73.47 -32.91 64.58 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.504 -178.442 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.591 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -66.49 -40.54 89.33 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.22 179.214 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.591 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 19.9 tpp180 . . . . . 0 N--CA 1.438 -1.029 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.912 -178.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.509 HD21 ' HB3' ' A' ' 79' ' ' LEU . 42.9 tp . . . . . 0 N--CA 1.437 -1.114 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.8 tp -66.43 -41.39 89.28 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 172.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 28.7 m -58.96 -41.93 88.69 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.2 m -66.66 -41.11 88.69 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-O 121.301 0.572 . . . . 0.0 111.154 175.443 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 15.9 t70 . . . . . 0 N--CA 1.477 0.896 0 C-N-CA 124.26 1.024 . . . . 0.0 110.347 178.246 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 24.4 ptm . . . . . 0 C--O 1.201 -1.477 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.425 ' HA ' HG22 ' B' ' 145' ' ' ILE . 22.0 mm-40 -37.89 -54.9 1.25 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 117.405 2.372 . . . . 0.0 117.405 -175.479 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 16.2 t -71.26 -30.81 66.75 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 119.749 -0.781 . . . . 0.0 110.317 -177.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 49.1 mm -74.82 -44.5 45.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.708 -179.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.425 HG22 ' HA ' ' B' ' 142' ' ' GLU . 18.5 tt -69.11 -31.32 49.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 CA-C-O 120.754 0.312 . . . . 0.0 110.248 -179.18 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 4.0 tpp180 -63.4 -61.51 2.3 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 40.3 t -55.01 -53.76 51.66 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.575 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -81.93 -46.1 14.5 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -172.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 72' ' ' ILE . 10.4 tt . . . . . 0 C--N 1.301 -1.538 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -169.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.432 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 13.4 ptpt . . . . . 0 N--CA 1.423 -1.819 0 CA-C-O 121.81 0.814 . . . . 0.0 113.022 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.45 -14.59 28.18 Favored Glycine 0 C--O 1.238 0.367 0 CA-C-N 113.762 -1.563 . . . . 0.0 115.079 -175.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.432 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 69.4 p-90 -73.69 -3.01 25.65 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 122.242 -0.564 . . . . 0.0 111.992 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 -62.91 -24.0 67.63 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 121.153 0.502 . . . . 0.0 110.971 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -79.19 -20.75 47.61 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.572 0.701 . . . . 0.0 109.786 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -90.29 2.84 55.07 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.649 -1.159 . . . . 0.0 110.116 -174.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.483 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.4 p -132.64 123.86 50.09 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.774 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 m -87.81 154.4 20.57 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.874 -175.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -55.5 -43.25 75.47 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 172.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -62.08 -32.59 73.15 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.499 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.501 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.24 -52.15 15.07 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 -177.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.541 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.4 ptm180 -63.79 -42.74 97.67 Favored 'General case' 0 N--CA 1.425 -1.698 0 CA-C-N 114.618 -1.174 . . . . 0.0 112.844 -178.135 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.1 t -65.66 -33.53 76.1 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.242 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -64.24 -44.41 91.91 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.757 HD23 HD21 ' A' ' 68' ' ' LEU . 4.8 mp -64.82 -39.45 93.61 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.235 178.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 15' ' ' ARG . 65.1 t -58.32 -51.04 76.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.512 0.725 . . . . 0.0 110.01 174.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.423 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 16.4 t-80 -51.98 -47.27 64.92 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 124.23 1.012 . . . . 0.0 110.503 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.622 ' HD3' HD22 ' B' ' 149' ' ' LEU . 40.3 mttm -68.71 -41.14 79.52 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.593 178.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.476 ' O ' HG22 ' A' ' 26' ' ' ILE . 31.6 mt -51.32 -50.27 59.73 Favored 'General case' 0 CA--C 1.501 -0.923 0 O-C-N 123.931 0.769 . . . . 0.0 109.743 175.249 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 43' ' ' LEU . 46.2 t -53.69 -53.78 23.74 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.577 0 O-C-N 124.549 1.155 . . . . 0.0 110.199 175.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.423 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 97.9 mt-30 -51.14 -39.38 56.14 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -177.076 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.43 ' HB3' HG13 ' A' ' 72' ' ' ILE . . . -81.71 -46.35 14.4 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.504 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.03 -23.8 17.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.881 0.848 . . . . 0.0 109.674 -174.637 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.538 ' CG ' HD22 ' A' ' 43' ' ' LEU . 50.6 m-85 -136.65 87.99 20.01 Favored Pre-proline 0 N--CA 1.408 -2.558 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.014 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -55.56 113.36 1.39 Allowed 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 121.583 1.522 . . . . 0.0 109.426 174.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -77.1 137.23 65.31 Favored Pre-proline 0 N--CA 1.42 -1.971 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.725 -176.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.43 -25.72 15.01 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.937 2.424 . . . . 0.0 111.814 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -151.97 144.41 16.74 Favored Pre-proline 0 CA--C 1.497 -1.087 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -177.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -60.25 -22.96 72.59 Favored 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.115 1.876 . . . . 0.0 113.131 175.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.55 -3.26 57.51 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 121.348 -0.845 . . . . 0.0 111.095 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.15 -9.94 59.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 173.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.46 ' HA ' ' CE ' ' A' ' 40' ' ' MET . 20.2 mt -88.44 6.75 36.09 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.611 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -136.06 12.28 3.34 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-O 121.937 0.875 . . . . 0.0 109.159 173.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.692 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 23.1 t70 -91.83 -179.82 5.42 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 114.416 -1.265 . . . . 0.0 110.614 -170.157 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.692 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.66 -26.86 62.71 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-O 121.02 0.438 . . . . 0.0 110.526 175.608 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.677 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -66.23 -30.07 70.44 Favored 'General case' 0 C--O 1.247 0.932 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 174.696 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.569 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.98 -40.85 90.51 Favored 'General case' 0 C--O 1.193 -1.884 0 CA-C-O 118.476 -0.773 . . . . 0.0 110.976 -179.004 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.2 pt-20 -61.49 -31.8 71.8 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.507 -174.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -75.68 -43.23 48.38 Favored 'General case' 0 C--O 1.262 1.76 0 CA-C-O 121.479 0.656 . . . . 0.0 110.57 176.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.677 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 17.9 mt -64.14 -47.29 80.52 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.261 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 40' ' ' MET . 27.7 m -69.37 -30.63 46.43 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.05 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.082 178.697 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.26 -50.42 69.54 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 175.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.565 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.1 t80 -59.68 -48.37 81.95 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.444 174.162 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.69 -38.39 87.65 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 120.552 -0.459 . . . . 0.0 112.085 -175.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.07 -45.81 76.2 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 123.036 0.535 . . . . 0.0 110.665 177.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -64.03 -38.14 89.98 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.485 0.66 . . . . 0.0 110.139 -177.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.489 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 50.0 t -73.1 -44.07 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.836 179.266 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -58.3 -45.63 87.62 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 177.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.76 -42.24 97.92 Favored Glycine 0 CA--C 1.503 -0.714 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.153 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.438 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 27.0 t70 -55.06 -54.37 43.93 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 123.026 0.53 . . . . 0.0 111.26 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.645 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -70.39 -30.35 67.23 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -179.611 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -62.32 -48.51 79.52 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 176.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -73.74 -24.24 59.87 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.519 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -75.03 -31.93 61.45 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-O 121.417 0.627 . . . . 0.0 110.037 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.56 167.09 12.83 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 121.683 0.754 . . . . 0.0 112.977 -175.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -118.5 11.35 12.9 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.97 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.3 p -164.76 156.22 15.27 Favored 'General case' 0 N--CA 1.421 -1.917 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.483 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.14 -28.16 63.08 Favored 'General case' 0 C--O 1.202 -1.404 0 C-N-CA 119.447 -0.901 . . . . 0.0 111.065 179.756 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -61.34 -47.79 84.26 Favored 'General case' 0 C--O 1.211 -0.925 0 O-C-N 123.66 0.6 . . . . 0.0 109.581 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 5.1 tp10 -60.93 -48.97 79.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.257 177.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -46.41 81.99 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.031 -175.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -62.66 -41.23 98.95 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 123.542 0.526 . . . . 0.0 109.742 176.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 -60.05 -57.54 12.39 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.131 0.572 . . . . 0.0 112.244 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.645 HD11 ' HB2' ' A' ' 54' ' ' MET . 3.6 pp -66.57 -32.08 73.19 Favored 'General case' 0 C--O 1.252 1.206 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -174.559 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.757 HD21 HD23 ' A' ' 18' ' ' LEU . 1.0 OUTLIER -75.86 -31.42 59.27 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.44 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.481 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -65.2 -34.39 78.26 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.77 175.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -68.82 -44.36 73.66 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.393 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.1 -39.08 86.65 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.174 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.482 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 7.2 tt -66.54 -44.3 90.25 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.47 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.224 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.452 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 54.4 t80 -55.36 -51.64 66.14 Favored 'General case' 0 C--O 1.255 1.386 0 C-N-CA 124.741 1.217 . . . . 0.0 111.022 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.87 -34.64 78.88 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.676 -178.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.15 -38.53 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.897 178.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.527 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 33.4 mt-30 -66.69 -41.57 87.84 Favored 'General case' 0 CA--C 1.509 -0.611 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.075 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.54 ' HA ' ' HG2' ' A' ' 80' ' ' GLU . 0.6 OUTLIER -71.7 -28.27 63.59 Favored 'General case' 0 N--CA 1.424 -1.741 0 C-N-CA 118.936 -1.106 . . . . 0.0 113.541 176.199 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -66.57 -42.3 87.26 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.594 ' O ' ' HB2' ' A' ' 83' ' ' ARG . 4.6 pp -65.83 -46.09 79.83 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.957 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 16.9 pt-20 -68.93 -35.36 76.71 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 119.246 -0.981 . . . . 0.0 111.904 -177.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.9 pt-20 -68.53 -42.08 78.98 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 120.039 -0.665 . . . . 0.0 111.168 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.613 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -70.02 -33.66 72.28 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.494 0.664 . . . . 0.0 110.761 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.613 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 26.5 ttt180 . . . . . 0 N--CA 1.428 -1.536 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.945 -172.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.52 HD21 ' HB3' ' A' ' 79' ' ' LEU . 26.3 tp . . . . . 0 N--CA 1.437 -1.104 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.598 HD23 ' NZ ' ' A' ' 82' ' ' LYS . 2.9 tm? -67.43 -35.93 80.22 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 172.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 47.0 m -62.7 -37.43 86.44 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 177.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 117' ' ' SER . . . . . 0.503 ' HB3' ' HA ' ' A' ' 27' ' ' PHE . 13.3 m -66.58 -49.54 66.05 Favored 'General case' 0 CA--C 1.557 1.219 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.509 173.545 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.2 t0 . . . . . 0 N--CA 1.487 1.408 0 C-N-CA 124.251 1.021 . . . . 0.0 111.149 179.322 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.512 ' HB3' ' HB ' ' B' ' 145' ' ' ILE . 63.6 mtm . . . . . 0 C--O 1.205 -1.267 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 8.57 -73.63 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 127.651 2.381 . . . . 0.0 117.147 -174.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 7.0 p -70.56 -44.76 66.77 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-O 121.544 0.688 . . . . 0.0 111.618 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 69.7 mt -62.32 -53.63 44.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.228 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.512 ' HB ' ' HB3' ' B' ' 141' ' ' MET . 16.2 tt -64.66 -31.3 53.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.822 -176.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -63.36 -54.44 36.92 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 39.0 t -67.09 -41.75 85.8 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.222 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -79.55 -53.91 6.41 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -174.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.622 HD22 ' HD3' ' A' ' 21' ' ' LYS . 10.2 tt . . . . . 0 C--N 1.303 -1.415 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt . . . . . 0 N--CA 1.424 -1.748 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.46 -14.35 8.99 Favored Glycine 0 N--CA 1.475 1.282 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 -170.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.2 p-90 -73.02 -11.69 60.65 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 117.535 0.667 . . . . 0.0 111.835 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.45 -18.39 50.98 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 121.248 0.547 . . . . 0.0 111.691 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -75.73 -21.73 57.23 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.301 0.572 . . . . 0.0 110.448 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -101.92 14.29 32.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.353 0.597 . . . . 0.0 111.631 -174.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.429 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 4.1 p -135.11 110.63 12.54 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.229 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.12 165.72 12.1 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.151 -0.931 . . . . 0.0 113.337 -176.19 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -59.85 -36.13 76.21 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.669 -176.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -71.8 -33.21 68.37 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.03 -0.668 . . . . 0.0 111.888 -176.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.547 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -66.81 -50.52 62.37 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.51 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.3 ptm180 -67.92 -42.91 80.35 Favored 'General case' 0 N--CA 1.413 -2.279 0 CA-C-N 114.291 -1.322 . . . . 0.0 112.433 -177.282 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.1 t -63.96 -26.99 68.83 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.197 0.523 . . . . 0.0 110.277 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 8.5 t60 -65.62 -52.63 50.48 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 175.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.772 HD23 HD21 ' A' ' 68' ' ' LEU . 4.4 mp -61.39 -42.66 99.08 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.356 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 15' ' ' ARG . 51.5 t -55.92 -50.32 69.74 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 C-N-CA 124.442 1.097 . . . . 0.0 110.487 175.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -55.33 -42.63 74.06 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 123.833 0.853 . . . . 0.0 110.477 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 46.6 mttm -69.58 -36.54 76.35 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.317 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 19' ' ' VAL . 83.5 mt -57.01 -42.1 79.7 Favored 'General case' 0 CA--C 1.518 -0.268 0 O-C-N 123.286 0.366 . . . . 0.0 110.022 175.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.487 HG11 ' HE1' ' A' ' 40' ' ' MET . 55.7 t -56.88 -52.84 50.12 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.148 0 O-C-N 124.22 0.95 . . . . 0.0 110.533 171.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -54.65 -33.54 60.8 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.453 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.0 -43.95 18.84 Favored 'General case' 0 C--O 1.206 -1.195 0 CA-C-O 121.16 0.505 . . . . 0.0 111.856 177.184 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.451 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.6 tt -73.72 -31.42 31.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 O-C-N 120.952 -1.092 . . . . 0.0 110.885 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.404 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 17.9 m-85 -132.07 95.44 21.86 Favored Pre-proline 0 C--N 1.264 -3.144 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.176 -176.183 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 18.7 Cg_endo -63.89 94.14 0.19 Allowed 'Trans proline' 0 C--N 1.358 1.034 0 C-N-CA 122.219 1.946 . . . . 0.0 110.556 177.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.411 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 14.6 t -62.94 132.56 95.01 Favored Pre-proline 0 N--CA 1.426 -1.649 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.383 -175.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -67.51 -33.14 29.88 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.7 2.267 . . . . 0.0 111.791 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -150.9 147.65 21.31 Favored Pre-proline 0 C--N 1.306 -1.289 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 -177.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -56.29 -17.87 22.3 Favored 'Trans proline' 0 CA--C 1.553 1.425 0 C-N-CA 122.507 2.138 . . . . 0.0 113.596 174.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.33 -6.02 59.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.696 -0.627 . . . . 0.0 112.193 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.411 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -81.84 -11.35 58.99 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 122.138 0.971 . . . . 0.0 108.8 175.053 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.463 ' O ' ' HG2' ' A' ' 40' ' ' MET . 33.8 mt -84.91 4.51 33.11 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.233 -1.348 . . . . 0.0 110.472 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -133.22 17.36 4.08 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-O 121.863 0.84 . . . . 0.0 109.856 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.584 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 37.2 t70 -92.02 177.11 6.27 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.827 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.81 -26.84 63.48 Favored 'General case' 0 C--N 1.307 -1.248 0 O-C-N 122.28 -0.262 . . . . 0.0 110.409 176.478 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.581 ' O ' HD13 ' A' ' 43' ' ' LEU . 39.8 ttm180 -60.08 -35.81 76.0 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.719 0.771 . . . . 0.0 109.558 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.61 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.8 tpp -57.83 -32.27 67.44 Favored 'General case' 0 C--O 1.2 -1.509 0 CA-C-N 114.603 -1.18 . . . . 0.0 112.228 178.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 13.5 pt-20 -64.28 -32.37 73.93 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 118.551 -1.26 . . . . 0.0 110.299 -178.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -72.6 -45.28 59.84 Favored 'General case' 0 C--O 1.253 1.27 0 CA-C-O 122.277 1.037 . . . . 0.0 109.139 176.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.581 HD13 ' O ' ' A' ' 39' ' ' ARG . 3.0 mp -55.7 -56.33 21.76 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 113.551 -1.659 . . . . 0.0 110.165 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.61 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 2.7 p -70.28 -27.55 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.858 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.176 -176.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.6 -49.36 76.67 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 176.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.526 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.1 t80 -62.21 -45.55 92.85 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.083 175.153 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.22 -45.99 83.34 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.915 -177.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -63.88 -43.84 94.84 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 124.055 0.942 . . . . 0.0 112.857 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 59.1 pttt -64.09 -41.05 97.44 Favored 'General case' 0 C--O 1.251 1.163 0 CA-C-O 121.582 0.706 . . . . 0.0 110.175 -177.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.479 HG21 ' CE2' ' A' ' 46' ' ' TYR . 55.9 t -73.1 -45.04 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.163 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.415 ' HG3' HG23 ' A' ' 19' ' ' VAL . 14.9 tm-20 -58.06 -45.25 87.37 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 177.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.25 -43.15 93.7 Favored Glycine 0 N--CA 1.438 -1.203 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.111 178.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -58.53 -54.12 50.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.661 0.267 . . . . 0.0 111.495 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.432 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -65.77 -31.43 72.4 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 179.665 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -65.05 -38.74 91.83 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -82.09 -23.25 35.85 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 121.747 -0.596 . . . . 0.0 112.063 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -80.22 -40.95 26.1 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 123.047 0.539 . . . . 0.0 111.473 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.17 161.09 29.1 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -106.12 7.4 31.68 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.829 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.5 p -159.11 157.9 31.88 Favored 'General case' 0 CA--C 1.477 -1.849 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.429 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -72.48 -24.43 61.18 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.066 -1.053 . . . . 0.0 109.614 178.184 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -67.57 -47.48 69.66 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 115.088 -0.96 . . . . 0.0 108.499 177.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -60.36 -46.59 89.39 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.496 175.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -46.4 85.87 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 123.319 0.387 . . . . 0.0 110.631 -177.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.402 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 2.9 t80 -62.0 -44.67 96.24 Favored 'General case' 0 C--O 1.216 -0.707 0 O-C-N 123.643 0.59 . . . . 0.0 110.679 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -67.7 -43.13 80.85 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.432 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.3 pp -71.69 -35.18 70.17 Favored 'General case' 0 C--O 1.25 1.079 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.123 -177.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.772 HD21 HD23 ' A' ' 18' ' ' LEU . 1.3 pp -72.26 -33.68 67.67 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.551 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.51 -39.63 94.93 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.03 176.096 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -62.15 -49.47 75.73 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.433 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -34.55 72.51 Favored 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.042 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.56 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 4.9 tt -70.88 -45.85 71.13 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.563 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -55.15 -50.75 68.48 Favored 'General case' 0 C--O 1.282 2.798 0 C-N-CA 124.665 1.186 . . . . 0.0 110.887 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -62.98 -39.5 94.91 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.629 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.453 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.3 mp -62.44 -39.92 86.14 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.981 0 O-C-N 123.356 0.41 . . . . 0.0 111.861 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.631 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 22.1 mm-40 -57.75 -49.67 75.81 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 121.87 0.843 . . . . 0.0 109.637 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.496 ' H ' ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -70.45 -38.21 74.44 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.661 0.985 . . . . 0.0 113.661 178.076 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.33 -45.53 91.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 3.7 pp -64.25 -42.82 96.33 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.489 -177.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.462 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 4.7 mm-40 -68.9 -41.44 78.25 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -70.47 -35.03 73.06 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 119.464 -0.894 . . . . 0.0 111.438 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.53 -29.87 62.74 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.549 0.69 . . . . 0.0 109.788 178.009 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 4.9 tmm_? . . . . . 0 C--N 1.321 -0.632 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.01 -177.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.526 HD21 ' HB3' ' A' ' 79' ' ' LEU . 31.8 tp . . . . . 0 C--O 1.199 -1.562 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.19 -40.03 82.32 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 174.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 43.6 m -63.81 -39.53 94.46 Favored 'General case' 0 CA--C 1.552 1.021 0 CA-C-O 121.353 0.597 . . . . 0.0 109.402 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.1 t -68.44 -42.49 78.76 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.398 177.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 16.9 t70 . . . . . 0 N--CA 1.476 0.844 0 C-N-CA 125.898 1.679 . . . . 0.0 111.278 179.328 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.514 ' HB3' ' HB ' ' B' ' 145' ' ' ILE . 69.3 mtp . . . . . 0 N--CA 1.434 -1.26 0 CA-C-O 119.457 -0.306 . . . . 0.0 110.423 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 25.64 -84.13 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 127.853 2.461 . . . . 0.0 115.502 176.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.1 p -72.86 -47.1 48.96 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 114.55 -1.204 . . . . 0.0 111.216 -175.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 65.3 mt -63.79 -41.91 94.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.767 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.514 ' HB ' ' HB3' ' B' ' 141' ' ' MET . 9.5 tp -66.19 -41.32 89.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.097 0 C-N-CA 119.617 -0.833 . . . . 0.0 110.693 -178.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -66.17 -57.08 8.4 Favored 'General case' 0 N--CA 1.436 -1.128 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.133 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 43.4 t -55.2 -53.96 49.41 Favored 'General case' 0 C--O 1.249 1.049 0 C-N-CA 123.757 0.823 . . . . 0.0 113.133 -176.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.444 ' O ' ' HB1' ' A' ' 69' ' ' ALA . 5.5 mm-40 -81.84 -42.25 19.89 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -172.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.495 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 1.5 tm? . . . . . 0 N--CA 1.454 -0.241 0 C-N-CA 120.469 -0.493 . . . . 0.0 110.358 -173.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.503 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.6 ptpt . . . . . 0 N--CA 1.427 -1.617 0 CA-C-O 121.643 0.735 . . . . 0.0 111.647 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.414 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -74.02 -0.68 57.17 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 114.589 -1.187 . . . . 0.0 113.702 -175.208 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.503 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 52.2 p-90 -72.67 -7.74 51.86 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 117.57 0.685 . . . . 0.0 111.584 177.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -65.99 -9.61 31.84 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 9.7 pt-20 -88.13 -8.64 55.12 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.272 0.558 . . . . 0.0 110.027 174.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -94.98 9.89 37.67 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.533 0.682 . . . . 0.0 109.867 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.421 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.6 p -141.79 155.17 19.8 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.2 m -123.69 160.59 26.88 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -57.62 -36.1 71.34 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 120.903 0.382 . . . . 0.0 110.226 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 4.0 m-20 -63.68 -33.69 76.19 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.521 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.17 -51.13 19.01 Favored 'General case' 0 CA--C 1.498 -1.055 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 -177.315 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.517 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -64.81 -44.18 90.75 Favored 'General case' 0 N--CA 1.423 -1.802 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.976 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.8 t -66.29 -29.17 69.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.438 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 18.2 t60 -65.18 -44.69 87.64 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.035 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.727 HD23 HD21 ' A' ' 68' ' ' LEU . 3.7 mp -66.6 -39.64 88.48 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.338 177.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 15' ' ' ARG . 55.0 t -57.45 -51.9 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.842 0.857 . . . . 0.0 110.3 175.188 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -55.98 -45.78 78.86 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.314 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -65.84 -40.22 91.55 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.245 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 19' ' ' VAL . 28.7 mt -51.26 -50.29 59.52 Favored 'General case' 0 CA--C 1.498 -1.048 0 O-C-N 123.676 0.61 . . . . 0.0 109.543 174.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.424 HG13 ' HB3' ' A' ' 43' ' ' LEU . 41.9 t -53.92 -51.69 42.92 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.497 0 O-C-N 124.468 1.105 . . . . 0.0 110.528 175.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -55.77 -35.41 66.21 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -176.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.486 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -81.44 -45.58 15.84 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 177.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.503 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.72 -25.49 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 122.044 0.926 . . . . 0.0 110.565 -174.682 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.587 ' CG ' HD22 ' A' ' 43' ' ' LEU . 57.6 m-85 -131.44 98.07 18.77 Favored Pre-proline 0 C--N 1.278 -2.514 0 CA-C-N 115.289 -0.869 . . . . 0.0 108.732 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -49.51 133.63 31.83 Favored 'Trans proline' 0 CA--C 1.48 -2.183 0 C-N-CA 122.394 2.063 . . . . 0.0 111.209 177.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.1 m -91.28 116.8 67.17 Favored Pre-proline 1 N--CA 1.369 -4.505 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.374 -174.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -79.92 -30.42 2.27 Favored 'Trans proline' 0 C--N 1.323 -0.78 0 C-N-CA 122.088 1.858 . . . . 0.0 111.255 176.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -147.84 147.43 27.03 Favored Pre-proline 0 CA--C 1.488 -1.431 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -69.2 -12.02 32.97 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 121.231 1.287 . . . . 0.0 110.283 172.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.32 -13.71 45.75 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.089 175.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.717 ' HA ' ' OD2' ' A' ' 37' ' ' ASP . . . -72.07 -15.17 62.01 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 122.18 0.991 . . . . 0.0 109.478 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.9 mt -85.36 7.34 22.79 Favored 'General case' 0 N--CA 1.426 -1.629 0 CA-C-N 113.592 -1.64 . . . . 0.0 109.403 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -132.89 0.44 3.5 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 118.984 -1.087 . . . . 0.0 109.914 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.717 ' OD2' ' HA ' ' A' ' 34' ' ' ALA . 48.5 m-20 -72.88 176.86 5.28 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.157 -175.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.645 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -65.35 -21.81 66.74 Favored 'General case' 0 C--O 1.203 -1.342 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 170.637 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.636 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 41.0 ttp180 -65.04 -29.52 70.43 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.19 175.443 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.589 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.02 -39.57 82.31 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-O 118.763 -0.636 . . . . 0.0 110.209 -179.503 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.8 pt-20 -62.81 -28.37 69.96 Favored 'General case' 0 C--O 1.205 -1.257 0 O-C-N 123.238 0.336 . . . . 0.0 110.946 -176.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -76.17 -46.18 29.78 Favored 'General case' 0 C--O 1.265 1.911 0 CA-C-O 121.696 0.76 . . . . 0.0 110.008 177.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 18.3 mt -63.81 -49.57 72.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.204 -178.173 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 40' ' ' MET . 34.0 m -68.52 -33.17 58.57 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.294 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.383 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.21 -46.97 75.92 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 118.325 0.511 . . . . 0.0 109.991 175.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.543 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 6.6 t80 -63.1 -48.64 77.7 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.645 174.258 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.35 -43.52 88.35 Favored 'General case' 0 C--O 1.201 -1.474 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.356 -176.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -66.19 -40.77 90.65 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 124.117 0.967 . . . . 0.0 111.827 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 53.2 pttt -66.71 -40.71 88.55 Favored 'General case' 0 C--O 1.251 1.151 0 CA-C-O 121.497 0.665 . . . . 0.0 109.945 -178.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.412 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 79.3 t -71.63 -49.23 47.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.605 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.3 tm-20 -57.93 -47.67 82.18 Favored 'General case' 0 CA--C 1.51 -0.594 0 C-N-CA 123.836 0.854 . . . . 0.0 109.17 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.77 -38.72 92.61 Favored Glycine 0 N--CA 1.428 -1.859 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.445 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -64.11 -51.78 62.34 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 111.543 0.201 . . . . 0.0 111.543 178.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.437 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -64.28 -32.38 73.96 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 178.025 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -64.78 -41.62 95.7 Favored 'General case' 0 C--O 1.201 -1.476 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -80.73 -16.78 53.0 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.622 -0.674 . . . . 0.0 112.097 177.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.3 t -82.78 -52.99 6.25 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 122.536 0.334 . . . . 0.0 111.433 -178.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.17 161.66 13.18 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -175.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -104.73 6.28 34.04 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.316 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.0 p -162.42 156.22 20.93 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 174.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -67.76 -31.15 70.84 Favored 'General case' 0 C--O 1.201 -1.499 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.458 -178.787 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -65.21 -47.22 77.64 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.303 177.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -58.26 -45.16 88.34 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 111.417 0.155 . . . . 0.0 111.417 175.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -44.14 92.21 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.513 -178.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -62.46 -45.59 92.35 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.295 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.529 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 34.0 m170 -61.1 -53.97 50.47 Favored 'General case' 0 C--O 1.215 -0.741 0 O-C-N 123.274 0.359 . . . . 0.0 111.634 -178.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.437 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.4 pp -64.33 -36.73 85.09 Favored 'General case' 0 C--O 1.256 1.417 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -175.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.727 HD21 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -74.67 -33.86 62.57 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.523 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.46 -32.76 74.3 Favored 'General case' 0 C--O 1.205 -1.275 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.343 175.405 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 22.1 mt-10 -72.4 -41.37 66.36 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.276 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -65.82 -39.03 90.45 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.403 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.523 HG22 ' HA ' ' A' ' 69' ' ' ALA . 8.7 tt -68.24 -42.99 85.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.297 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.491 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 39.1 t80 -58.19 -52.48 65.38 Favored 'General case' 0 C--O 1.259 1.578 0 C-N-CA 124.427 1.091 . . . . 0.0 111.348 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -64.4 -33.34 75.63 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.464 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -68.92 -37.68 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.867 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.167 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.509 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 11.5 mt-30 -66.6 -41.48 88.38 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.629 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.511 ' HB3' ' HE2' ' A' ' 77' ' ' LYS . 10.6 ptpt -75.23 -27.09 59.37 Favored 'General case' 0 N--CA 1.424 -1.763 0 C-N-CA 118.982 -1.087 . . . . 0.0 112.759 176.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.518 ' OE2' ' HG2' ' A' ' 82' ' ' LYS . 5.5 tm-20 -62.56 -48.89 77.51 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 175.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.597 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -63.7 -39.67 94.89 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.836 178.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -55.56 -53.6 54.4 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 123.466 0.479 . . . . 0.0 111.289 176.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -68.92 -47.03 66.78 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 120.15 -0.62 . . . . 0.0 112.418 -177.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.518 ' HG2' ' OE2' ' A' ' 78' ' ' GLU 0.254 0.0 OUTLIER -74.09 -38.73 63.79 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -176.337 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 7.6 mmm180 . . . . . 0 C--N 1.307 -1.279 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.597 HD21 ' HB3' ' A' ' 79' ' ' LEU . 52.9 tp . . . . . 0 C--O 1.201 -1.454 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.2 tp -67.83 -36.71 80.83 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.192 177.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 88.0 m -64.92 -46.73 80.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.097 176.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.5 m -64.12 -38.08 89.76 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.616 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 C--N 1.317 -0.805 0 C-N-CA 123.746 0.818 . . . . 0.0 111.851 177.332 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 24.9 ptt? . . . . . 0 C--O 1.208 -1.103 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -28.51 -61.14 0.12 Allowed 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 126.543 1.937 . . . . 0.0 116.162 -172.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 18.5 m -68.04 -35.72 78.72 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.105 0.478 . . . . 0.0 111.48 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 62.1 mt -72.16 -45.79 60.9 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.891 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.601 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 18.0 tt -68.26 -31.57 52.09 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.4 -178.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 49.3 ttp180 -64.86 -54.75 26.07 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 33.1 t -59.24 -50.15 75.11 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.787 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -81.27 -42.69 20.28 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -175.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.601 ' HB3' ' O ' ' B' ' 145' ' ' ILE . 4.0 tt . . . . . 0 C--N 1.31 -1.119 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -172.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 14.6 ptpt . . . . . 0 N--CA 1.43 -1.461 0 CA-C-O 121.34 0.59 . . . . 0.0 111.669 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.2 -12.26 16.02 Favored Glycine 0 N--CA 1.465 0.612 0 N-CA-C 116.075 1.19 . . . . 0.0 116.075 -173.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.471 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 57.3 p-90 -64.06 -17.07 63.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.542 0.671 . . . . 0.0 111.035 178.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.471 ' HA ' HG12 ' A' ' 10' ' ' VAL . 1.4 p-80 -63.33 -10.39 16.2 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.7 -30.45 59.32 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.349 0.595 . . . . 0.0 109.88 175.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -93.11 20.41 6.87 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.524 -174.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.471 HG12 ' HA ' ' A' ' 7' ' ' HIS . 7.7 p -132.98 110.19 15.1 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.396 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -75.89 153.07 36.98 Favored 'General case' 0 C--N 1.294 -1.839 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.916 -173.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -60.63 -38.84 86.1 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 174.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.513 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 3.5 m-20 -56.91 -39.14 73.89 Favored 'General case' 0 C--O 1.214 -0.763 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.629 174.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.584 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -72.42 -52.35 16.33 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -173.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.6 ptm180 -66.15 -43.37 87.21 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-N 114.944 -1.025 . . . . 0.0 113.293 -176.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.2 t -67.11 -28.66 68.34 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 14.9 t60 -65.71 -44.12 87.04 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 176.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.698 HD23 HD21 ' A' ' 68' ' ' LEU . 4.1 mp -65.26 -41.41 94.27 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.888 176.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 15' ' ' ARG . 67.6 t -57.21 -52.42 56.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.665 0.786 . . . . 0.0 110.169 176.093 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.435 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 20.5 t-80 -54.93 -43.79 73.65 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.494 177.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.476 ' HD3' ' HG ' ' B' ' 149' ' ' LEU . 36.2 mttp -66.1 -37.95 87.02 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.375 177.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 19' ' ' VAL . 74.2 mt -55.67 -43.08 75.99 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 175.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.482 ' HA ' HG22 ' A' ' 26' ' ' ILE . 53.6 t -57.25 -52.65 53.84 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.628 0 O-C-N 124.155 0.91 . . . . 0.0 110.411 173.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -59.05 -29.15 67.09 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.71 -45.31 15.88 Favored 'General case' 0 C--O 1.207 -1.133 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.769 174.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.482 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.7 tt -69.78 -33.75 57.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-O 122.07 0.938 . . . . 0.0 110.233 -177.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -126.39 92.26 45.77 Favored Pre-proline 0 N--CA 1.4 -2.971 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -57.7 102.17 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 121.849 1.7 . . . . 0.0 107.955 171.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 t -73.92 128.27 86.88 Favored Pre-proline 0 N--CA 1.408 -2.568 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.637 -172.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -72.65 -28.83 13.66 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.417 2.078 . . . . 0.0 111.438 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -151.01 147.12 20.04 Favored Pre-proline 0 CA--C 1.498 -1.033 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -177.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.41 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 9.9 Cg_endo -56.93 -19.66 33.03 Favored 'Trans proline' 0 CA--C 1.549 1.274 0 C-N-CA 122.359 2.039 . . . . 0.0 114.171 175.053 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.38 -19.97 59.24 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 121.406 -0.809 . . . . 0.0 112.005 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.68 -7.56 50.99 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.383 0.611 . . . . 0.0 110.421 178.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.462 ' O ' ' HG2' ' A' ' 40' ' ' MET . 23.6 mt -93.48 0.31 56.68 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.689 -178.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -133.72 19.77 3.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.243 0.544 . . . . 0.0 111.979 -177.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.548 ' O ' ' HB3' ' A' ' 40' ' ' MET . 38.0 t70 -92.12 176.69 6.4 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.734 ' HD2' ' N ' ' A' ' 39' ' ' ARG . 5.4 ppt_? -61.54 -26.1 67.72 Favored 'General case' 0 C--N 1.282 -2.358 0 CA-C-O 121.922 0.868 . . . . 0.0 108.934 172.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.734 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 40.6 ttm180 -63.52 -29.41 70.68 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-O 122.145 0.974 . . . . 0.0 109.109 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.726 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.7 tpp -65.13 -34.64 78.89 Favored 'General case' 0 C--O 1.192 -1.95 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.312 -178.355 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.631 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.1 pt-20 -63.64 -32.89 74.51 Favored 'General case' 0 C--O 1.189 -2.081 0 C-N-CA 119.396 -0.922 . . . . 0.0 109.445 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -68.99 -49.85 54.21 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 121.589 0.709 . . . . 0.0 110.045 176.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 67.2 mt -63.7 -48.07 78.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.6 -176.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.726 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.4 p -73.42 -27.88 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.885 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.209 -178.02 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.56 93.94 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 177.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.539 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.1 t80 -60.73 -46.36 90.74 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.942 174.093 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.23 -40.17 93.01 Favored 'General case' 0 C--O 1.202 -1.443 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.956 -177.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -68.38 -43.72 76.73 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 123.312 0.645 . . . . 0.0 111.306 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.3 pttp -65.74 -38.18 88.42 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 121.118 0.485 . . . . 0.0 109.918 -177.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 41.3 t -70.76 -49.66 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.268 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.401 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -56.04 -44.67 79.0 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.49 -37.97 95.6 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.62 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -59.42 -54.25 48.81 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.445 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -67.67 -34.22 76.5 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.93 -49.85 75.79 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -77.33 -17.68 58.08 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 28.3 t -87.42 -30.85 20.4 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 120.825 0.345 . . . . 0.0 110.929 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.29 159.51 23.13 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 121.246 0.546 . . . . 0.0 111.633 -177.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -108.59 8.48 27.15 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-O 121.717 0.77 . . . . 0.0 110.4 -177.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 83.1 p -160.71 160.71 31.78 Favored 'General case' 0 N--CA 1.417 -2.101 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 173.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.426 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -72.3 -26.76 62.08 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.047 176.677 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -65.48 -47.82 74.77 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -62.83 -46.22 88.94 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.163 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.404 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.64 -48.09 76.09 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.845 -176.419 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -61.38 -45.36 94.67 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 123.796 0.685 . . . . 0.0 110.304 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.543 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 10.7 t60 -67.95 -49.86 59.3 Favored 'General case' 0 C--O 1.203 -1.372 0 CA-C-O 119.23 -0.414 . . . . 0.0 111.752 -176.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.445 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.1 pp -64.55 -35.37 80.76 Favored 'General case' 0 C--O 1.271 2.219 0 CA-C-N 118.517 0.599 . . . . 0.0 111.662 -177.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.698 HD21 HD23 ' A' ' 18' ' ' LEU . 1.3 pp -70.1 -38.55 75.67 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.585 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.548 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.75 -35.74 82.06 Favored 'General case' 0 C--O 1.2 -1.508 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.561 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 16.0 mt-10 -67.76 -43.78 79.04 Favored 'General case' 0 C--N 1.312 -1.039 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.684 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -38.93 74.76 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 118.663 -1.215 . . . . 0.0 111.732 -179.034 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.548 HG22 ' HA ' ' A' ' 69' ' ' ALA . 9.6 tt -65.62 -40.41 87.92 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 C-N-CA 120.564 -0.455 . . . . 0.0 110.112 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.493 ' CZ ' ' HE3' ' A' ' 77' ' ' LYS . 36.6 t80 -57.31 -54.5 46.15 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 124.682 1.193 . . . . 0.0 111.121 179.343 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.473 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.5 ptpt -66.44 -32.34 73.64 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.083 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.78 -36.92 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.809 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.154 177.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.566 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 19.6 mt-30 -67.44 -47.75 69.26 Favored 'General case' 0 CA--C 1.498 -1.056 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.635 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.505 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -69.45 -28.12 65.83 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.404 -0.919 . . . . 0.0 112.627 177.505 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.6 tp10 -65.16 -47.85 75.59 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -65.41 -36.07 82.82 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.533 -178.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.98 -47.29 78.08 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.351 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.37 -33.37 65.01 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 119.49 -0.884 . . . . 0.0 111.773 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.553 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -64.58 -36.17 83.37 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.794 178.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.417 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 16.2 tpp180 . . . . . 0 N--CA 1.442 -0.855 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.227 178.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.558 HD21 ' HB3' ' A' ' 79' ' ' LEU . 62.4 tp . . . . . 0 C--O 1.203 -1.389 0 CA-C-O 120.438 0.161 . . . . 0.0 110.618 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 60.8 tp -63.57 -38.82 92.57 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 26.4 m -65.19 -40.15 93.84 Favored 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.983 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.3 t -77.53 -25.58 50.34 Favored 'General case' 0 CA--C 1.561 1.389 0 CA-C-O 121.28 0.562 . . . . 0.0 110.204 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 12.3 t70 . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 121.951 0.882 . . . . 0.0 109.163 176.851 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 C--O 1.198 -1.632 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -22.02 -65.42 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 126.876 2.071 . . . . 0.0 116.218 -174.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.4 p -69.84 -43.92 70.97 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.256 0.551 . . . . 0.0 112.01 -176.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 45.8 mm -69.57 -40.54 79.7 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.465 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 13.2 tt -67.42 -36.78 77.47 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.863 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -55.03 -51.64 65.65 Favored 'General case' 0 C--O 1.25 1.11 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.3 m -61.48 -52.36 64.83 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-N 114.509 -1.223 . . . . 0.0 112.567 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -68.52 -47.83 65.94 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.48 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 2.5 tm? . . . . . 0 C--N 1.306 -1.286 0 CA-C-N 114.953 -1.021 . . . . 0.0 112.756 -168.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.624 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.3 ptpt . . . . . 0 N--CA 1.411 -2.38 0 CA-C-O 121.678 0.752 . . . . 0.0 112.048 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.15 -9.65 84.1 Favored Glycine 0 C--O 1.24 0.517 0 CA-C-N 115.076 -0.965 . . . . 0.0 113.273 -175.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.624 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 65.0 p-90 -68.73 -7.59 35.07 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -59.83 -26.17 65.57 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 120.977 0.418 . . . . 0.0 111.703 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -86.81 0.33 55.04 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.547 0.689 . . . . 0.0 110.677 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -104.95 3.01 30.28 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.953 -178.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.773 HG22 ' HB3' ' A' ' 61' ' ' ARG . 1.5 t -119.28 128.51 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.681 0 N-CA-C 103.968 -2.604 . . . . 0.0 103.968 176.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.478 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -77.66 151.46 34.26 Favored 'General case' 0 C--N 1.275 -2.665 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -61.32 -36.15 79.35 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 174.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 32.8 t70 -72.66 -27.83 62.35 Favored 'General case' 0 C--O 1.199 -1.581 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.619 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.449 ' H ' ' HB ' ' A' ' 11' ' ' THR . 3.2 tm? -70.03 -52.95 19.92 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -177.652 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 1.1 ptm180 -57.89 -48.67 79.16 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 175.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.4 m -67.89 -21.19 65.16 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.192 0.52 . . . . 0.0 111.816 -177.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.446 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 15.9 t60 -69.63 -47.24 64.11 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 175.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.648 HD23 HD21 ' A' ' 68' ' ' LEU . 1.2 mp -64.83 -40.52 95.31 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.768 177.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' ARG . 78.8 t -56.69 -50.38 74.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.68 0.792 . . . . 0.0 109.939 174.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 27.0 t-80 -54.86 -44.15 73.74 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.861 0.864 . . . . 0.0 109.907 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.4 ' HZ3' ' CD1' ' B' ' 145' ' ' ILE . 76.7 mttt -69.48 -36.63 76.72 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.924 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' HG22 ' A' ' 26' ' ' ILE . 63.7 mt -56.38 -45.28 80.64 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 175.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.428 ' HA ' HG22 ' A' ' 26' ' ' ILE . 42.1 t -54.88 -55.56 15.26 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.41 0 O-C-N 124.211 0.944 . . . . 0.0 109.907 172.26 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -56.63 -30.1 62.93 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -176.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.606 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.32 -45.14 16.62 Favored 'General case' 0 C--O 1.208 -1.081 0 O-C-N 122.18 -0.325 . . . . 0.0 111.717 175.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.428 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.8 tt -70.82 -34.92 58.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 122.051 0.929 . . . . 0.0 110.304 -179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.467 ' CD2' HD22 ' A' ' 43' ' ' LEU . 11.0 m-85 -136.99 88.01 18.35 Favored Pre-proline 0 C--N 1.267 -3.003 0 C-N-CA 124.357 1.063 . . . . 0.0 109.751 -177.28 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -44.76 133.03 10.47 Favored 'Trans proline' 0 CA--C 1.487 -1.864 0 C-N-CA 122.696 2.264 . . . . 0.0 112.431 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 m -90.27 117.92 68.41 Favored Pre-proline 1 N--CA 1.364 -4.737 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.746 -173.719 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -76.29 -32.38 4.04 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.702 2.268 . . . . 0.0 111.745 178.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -153.59 144.17 15.83 Favored Pre-proline 0 CA--C 1.489 -1.372 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 -177.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.449 ' HA ' HD12 ' A' ' 35' ' ' LEU . 9.4 Cg_endo -56.02 -23.25 42.71 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.68 2.253 . . . . 0.0 113.817 176.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.26 -14.18 60.88 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 121.377 -0.827 . . . . 0.0 111.719 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 40' ' ' MET . . . -72.29 -15.55 61.9 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.697 0.761 . . . . 0.0 109.487 176.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.85 ' HA ' ' HE3' ' A' ' 40' ' ' MET . 10.4 mt -88.32 -0.87 57.63 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.043 -176.417 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.39 16.82 4.04 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.648 0.737 . . . . 0.0 109.29 176.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.584 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 17.0 t70 -86.36 173.55 9.62 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.109 -176.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.67 -25.68 62.21 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.025 0.44 . . . . 0.0 110.651 174.262 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.588 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 6.4 tpt180 -62.84 -38.09 89.4 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 175.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.85 ' HE3' ' HA ' ' A' ' 35' ' ' LEU . 9.3 tpp -56.16 -37.18 69.19 Favored 'General case' 0 C--O 1.192 -1.932 0 CA-C-N 113.574 -1.648 . . . . 0.0 112.691 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -61.79 -32.73 73.04 Favored 'General case' 0 C--O 1.212 -0.887 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.652 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -77.21 -43.5 33.43 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-O 121.406 0.622 . . . . 0.0 110.0 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 20.5 mt -63.72 -45.71 88.7 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.644 -178.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.839 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.0 p -73.34 -28.58 25.84 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.368 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.13 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.24 -44.23 95.43 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 176.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.531 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.5 t80 -62.51 -45.8 91.33 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.888 173.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.72 91.55 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.943 -177.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -68.25 -41.05 81.71 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 123.608 0.763 . . . . 0.0 112.375 178.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.531 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 58.3 pttt -65.84 -40.3 91.6 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 55.5 t -71.06 -48.33 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.884 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -58.25 -45.72 87.28 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.85 -42.42 96.6 Favored Glycine 0 N--CA 1.433 -1.522 0 O-C-N 123.928 0.768 . . . . 0.0 112.744 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -58.18 -54.7 44.03 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.489 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.6 OUTLIER -67.0 -33.9 76.56 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.502 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -63.62 -45.17 91.52 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -79.05 -16.59 56.59 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 121.888 -0.507 . . . . 0.0 111.727 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.489 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 29.9 m -87.1 -27.81 22.89 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.63 167.39 15.38 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.52 0.676 . . . . 0.0 112.576 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -115.31 8.63 15.47 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.532 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.4 p -166.66 150.27 7.05 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 175.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.773 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -60.82 -34.15 74.1 Favored 'General case' 0 C--O 1.199 -1.598 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.3 175.966 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.78 -47.91 83.79 Favored 'General case' 0 C--O 1.219 -0.542 0 O-C-N 123.857 0.723 . . . . 0.0 109.571 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -62.96 -47.34 83.61 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.715 177.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.407 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.57 -46.39 82.94 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.875 -176.768 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -60.92 -44.87 96.59 Favored 'General case' 0 C--O 1.208 -1.13 0 O-C-N 123.84 0.713 . . . . 0.0 109.752 177.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.426 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 53.6 t-80 -58.43 -57.21 13.95 Favored 'General case' 0 C--N 1.323 -0.543 0 O-C-N 123.606 0.566 . . . . 0.0 111.815 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.473 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.7 pp -65.41 -37.11 85.97 Favored 'General case' 0 C--O 1.27 2.156 0 CA-C-O 121.317 0.579 . . . . 0.0 112.167 -175.595 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.648 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -70.7 -36.89 73.48 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 -179.174 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.52 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.72 -38.39 90.28 Favored 'General case' 0 C--O 1.209 -1.077 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.232 178.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 53.5 mm-40 -61.15 -51.23 69.93 Favored 'General case' 0 C--O 1.262 1.735 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.701 179.265 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -39.38 81.11 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.587 -0.845 . . . . 0.0 112.621 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.582 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 6.8 tt -64.49 -44.89 96.96 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.891 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.803 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.411 ' CE1' ' HE2' ' A' ' 77' ' ' LYS . 65.3 t80 -53.4 -52.79 58.19 Favored 'General case' 0 C--O 1.259 1.574 0 C-N-CA 125.227 1.411 . . . . 0.0 111.238 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.67 -32.26 73.72 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.808 -178.312 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.606 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.5 mp -70.83 -35.63 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.298 176.057 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 72' ' ' ILE . 22.7 mm-40 -60.03 -47.58 85.25 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 122.08 0.943 . . . . 0.0 109.703 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.1 OUTLIER -72.79 -28.12 62.4 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.521 -0.872 . . . . 0.0 112.872 178.605 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.39 -53.43 57.73 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 175.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -60.35 -41.59 93.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.941 -177.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -59.1 -53.67 55.7 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.239 176.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.9 pt-20 -71.58 -37.76 70.99 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -174.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -33.36 62.34 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 . . . . . 0 N--CA 1.476 0.861 0 CA-C-O 121.852 0.834 . . . . 0.0 109.915 178.361 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.419 HD21 ' HB3' ' A' ' 79' ' ' LEU . 50.8 tp . . . . . 0 C--O 1.189 -2.115 0 CA-C-O 119.874 -0.108 . . . . 0.0 110.783 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.412 ' HA ' ' HB3' ' B' ' 118' ' ' ASP . 59.0 tp -68.6 -40.01 80.64 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 121.334 0.588 . . . . 0.0 109.685 176.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 36.6 m -60.72 -38.1 83.97 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.14 178.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.4 m -72.27 -50.46 26.98 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-O 121.388 0.613 . . . . 0.0 111.062 174.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' B' ' 115' ' ' LEU . 3.2 t70 . . . . . 0 N--CA 1.493 1.719 0 C-N-CA 126.766 2.026 . . . . 0.0 113.941 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.439 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 25.4 ttt . . . . . 0 N--CA 1.434 -1.272 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -42.37 -53.36 4.25 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 -169.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.3 p -64.82 -50.43 66.73 Favored 'General case' 0 C--O 1.255 1.375 0 CA-C-O 121.55 0.691 . . . . 0.0 111.115 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 63.2 mt -58.0 -50.77 76.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.78 -177.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.483 HD11 HD22 ' B' ' 149' ' ' LEU . 0.0 OUTLIER -67.01 -40.37 85.41 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.276 -177.252 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -64.61 -58.5 6.18 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 118.954 -1.098 . . . . 0.0 111.23 -176.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.9 m -66.1 -41.1 91.07 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 -175.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -81.6 -48.05 12.26 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.349 0.499 . . . . 0.0 112.349 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.508 HD21 HD13 ' A' ' 72' ' ' ILE . 9.4 tt . . . . . 0 C--N 1.319 -0.758 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -170.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.6 mttp . . . . . 0 N--CA 1.441 -0.901 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.43 -15.47 61.47 Favored Glycine 0 C--N 1.315 -0.639 0 O-C-N 123.428 0.455 . . . . 0.0 113.88 -174.035 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -72.38 -8.35 54.5 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 122.335 -0.509 . . . . 0.0 112.355 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.4 p-80 -62.4 -21.89 65.73 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.315 0.579 . . . . 0.0 110.425 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.17 -7.44 57.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.985 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -112.91 18.01 18.48 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.936 -178.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.57 125.48 19.05 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.23 159.24 19.52 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -176.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -59.01 -38.21 78.71 Favored 'General case' 0 C--O 1.208 -1.096 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 170.28 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.518 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 6.6 m-20 -65.86 -31.24 72.07 Favored 'General case' 0 C--O 1.202 -1.421 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.57 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -67.55 -51.88 45.44 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 179.295 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.58 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.0 ptm180 -64.61 -46.78 81.15 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.209 -1.359 . . . . 0.0 112.536 -177.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.6 t -66.45 -23.19 66.24 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-O 121.275 0.56 . . . . 0.0 110.899 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.518 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 9.5 t60 -69.54 -47.35 64.01 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 176.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.806 HD23 HD21 ' A' ' 68' ' ' LEU . 5.2 mp -65.01 -41.57 95.23 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.323 -1.308 . . . . 0.0 109.898 177.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 15' ' ' ARG . 67.7 t -55.81 -48.67 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 124.115 0.966 . . . . 0.0 110.39 175.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -55.75 -48.82 74.61 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.433 178.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.5 mttm -65.1 -37.31 87.07 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.026 178.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.464 ' O ' HG22 ' A' ' 26' ' ' ILE . 57.2 mt -53.51 -49.33 67.79 Favored 'General case' 0 CA--C 1.502 -0.869 0 O-C-N 123.577 0.548 . . . . 0.0 109.8 175.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.499 HG11 ' HE1' ' A' ' 40' ' ' MET . 58.6 t -54.87 -51.88 48.43 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.147 0 O-C-N 124.328 1.017 . . . . 0.0 110.172 175.555 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -56.72 -31.94 65.02 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -177.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.535 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.14 -45.94 15.65 Favored 'General case' 0 C--O 1.215 -0.757 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 176.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.464 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -79.9 -27.38 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-O 122.055 0.931 . . . . 0.0 111.013 -173.719 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -133.17 87.37 39.27 Favored Pre-proline 0 C--N 1.285 -2.21 0 C-N-CA 124.516 1.126 . . . . 0.0 108.997 177.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -58.37 116.1 3.01 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.164 1.909 . . . . 0.0 110.48 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.2 t -88.93 132.41 38.27 Favored Pre-proline 0 N--CA 1.424 -1.741 0 CA-C-O 121.104 0.478 . . . . 0.0 111.308 -174.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.63 -28.7 13.86 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.595 2.197 . . . . 0.0 111.331 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -148.98 155.61 40.48 Favored Pre-proline 0 C--N 1.31 -1.117 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.483 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.512 ' HA ' HD12 ' A' ' 35' ' ' LEU . 57.1 Cg_endo -73.52 -7.44 20.29 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.005 1.803 . . . . 0.0 114.367 179.635 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.59 -20.62 26.15 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 121.519 -0.738 . . . . 0.0 110.049 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.77 -12.31 58.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.863 0.839 . . . . 0.0 110.031 174.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 32' ' ' PRO . 27.6 mt -89.53 2.14 54.99 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.029 -179.253 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.89 9.93 4.22 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.742 0.782 . . . . 0.0 109.432 175.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.637 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 15.7 t70 -86.78 174.28 8.9 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 124.888 1.275 . . . . 0.0 111.004 -175.457 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.637 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -64.69 -29.19 70.18 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 123.266 0.626 . . . . 0.0 111.17 179.454 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.537 ' O ' HD13 ' A' ' 43' ' ' LEU . 41.2 ttm180 -66.38 -37.24 84.81 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 177.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.809 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 7.5 tpp -58.06 -35.56 71.53 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.716 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.2 pt-20 -61.64 -30.98 71.07 Favored 'General case' 0 C--O 1.209 -1.077 0 C-N-CA 118.63 -1.228 . . . . 0.0 109.369 -178.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -74.8 -46.44 36.82 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.461 177.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.624 HD22 ' HA ' ' A' ' 40' ' ' MET . 1.2 mp -55.1 -58.39 7.87 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.342 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.809 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.8 p -69.59 -29.27 40.82 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.346 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.744 -176.155 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.3 -47.45 85.35 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.477 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.554 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.3 t80 -59.93 -44.83 94.11 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 174.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.42 -42.29 99.34 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.055 -177.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -65.3 -44.11 88.97 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 123.2 0.6 . . . . 0.0 111.002 178.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.554 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 53.7 pttt -65.25 -40.71 94.37 Favored 'General case' 0 C--O 1.246 0.877 0 CA-C-O 121.284 0.564 . . . . 0.0 110.623 -178.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.446 HG21 ' CE2' ' A' ' 46' ' ' TYR . 43.0 t -70.95 -44.21 75.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.953 178.482 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -56.89 -46.66 81.73 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.09 -34.29 88.54 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.202 177.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 30.0 t70 -61.21 -53.8 52.34 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.005 0.431 . . . . 0.0 110.326 178.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.457 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -70.35 -31.07 68.19 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.701 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -59.47 -48.82 80.18 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -76.78 -24.9 52.88 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.516 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.8 t -80.33 -11.23 59.73 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -107.53 165.63 11.27 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.975 0.416 . . . . 0.0 111.503 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -112.39 14.21 20.34 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.376 0.607 . . . . 0.0 111.529 177.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 99.6 p -162.26 153.53 17.99 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 171.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.514 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -58.59 -41.18 85.19 Favored 'General case' 0 C--O 1.192 -1.932 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.978 174.525 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -65.35 -39.92 92.98 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.435 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -63.53 -50.43 69.6 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.145 175.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.467 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -62.7 -44.24 96.75 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.827 -177.892 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.48 -46.82 88.71 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 124.166 0.916 . . . . 0.0 110.44 177.243 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.595 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 24.2 t60 -63.38 -50.96 67.83 Favored 'General case' 0 C--O 1.202 -1.419 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.271 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.457 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -64.68 -37.66 88.33 Favored 'General case' 0 C--O 1.276 2.493 0 CA-C-O 121.514 0.674 . . . . 0.0 111.877 -176.756 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.806 HD21 HD23 ' A' ' 18' ' ' LEU . 1.5 pp -69.59 -35.5 75.38 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 178.171 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.542 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.83 -35.5 80.83 Favored 'General case' 0 C--O 1.204 -1.298 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.747 177.202 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 26.6 mt-10 -66.23 -47.37 74.02 Favored 'General case' 0 C--O 1.252 1.233 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.861 -179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -40.47 87.96 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 118.578 -1.249 . . . . 0.0 110.599 -178.173 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.542 HG22 ' HA ' ' A' ' 69' ' ' ALA . 4.4 tt -65.74 -44.13 93.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.117 -178.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.441 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 53.9 t80 -56.39 -53.11 61.25 Favored 'General case' 0 C--O 1.273 2.304 0 C-N-CA 125.36 1.464 . . . . 0.0 110.947 -178.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.5 ptpt -63.48 -39.55 94.74 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.661 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.535 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -61.89 -39.21 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 123.343 0.402 . . . . 0.0 111.514 178.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.7 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 1.9 mm100 -60.1 -53.48 57.28 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.452 ' HB3' ' HE2' ' A' ' 77' ' ' LYS . 6.7 ptpt -73.6 -28.78 62.0 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.469 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 8.1 tp10 -59.29 -47.94 83.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 175.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.1 pp -67.27 -37.42 83.42 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.188 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.492 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 4.7 mm-40 -61.12 -53.19 60.1 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.0 pt-20 -73.36 -32.96 64.82 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.073 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.556 ' HE2' ' HG3' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -66.07 -31.03 71.67 Favored 'General case' 0 C--N 1.352 0.674 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.095 179.081 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.556 ' HG3' ' HE2' ' A' ' 82' ' ' LYS . 51.3 mtm180 . . . . . 0 N--CA 1.454 -0.232 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.866 173.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.546 HD21 ' HB3' ' A' ' 79' ' ' LEU . 50.7 tp . . . . . 0 C--O 1.19 -2.042 0 N-CA-C 111.43 0.159 . . . . 0.0 111.43 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 55.6 tp -65.61 -33.73 76.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.104 0.478 . . . . 0.0 109.829 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 31.3 m -64.45 -45.38 87.67 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.417 175.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 13.0 m -67.77 -35.21 78.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 121.746 0.784 . . . . 0.0 110.095 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 6.4 t70 . . . . . 0 C--N 1.317 -0.813 0 C-N-CA 125.494 1.518 . . . . 0.0 109.903 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.507 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 44.4 ttp . . . . . 0 C--O 1.205 -1.244 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -38.24 -60.13 0.81 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 116.519 2.044 . . . . 0.0 116.519 -174.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.9 m -66.78 -39.67 87.89 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.22 0.533 . . . . 0.0 110.212 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 86.2 mt -64.98 -53.01 46.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.847 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.507 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 18.4 tt -68.37 -31.6 52.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 120.928 0.394 . . . . 0.0 112.061 -175.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -69.45 -51.52 35.38 Favored 'General case' 0 N--CA 1.419 -1.993 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.688 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 53.6 p -67.4 -42.45 83.28 Favored 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.267 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -80.62 -40.28 25.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -176.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 72' ' ' ILE . 10.0 tt . . . . . 0 C--N 1.314 -0.952 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -171.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.426 ' HB2' ' NE1' ' A' ' 6' ' ' TRP . 13.8 ptpt . . . . . 0 N--CA 1.431 -1.39 0 CA-C-O 121.52 0.676 . . . . 0.0 109.521 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.9 -20.25 1.77 Allowed Glycine 0 N--CA 1.473 1.136 0 C-N-CA 125.7 1.619 . . . . 0.0 116.842 -171.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.426 ' NE1' ' HB2' ' A' ' 4' ' ' LYS . 65.6 p-90 -66.12 -15.07 62.79 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 117.444 0.622 . . . . 0.0 111.562 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' HIS . . . . . 0.571 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 43.0 p-80 -59.8 -25.08 64.65 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.171 0.588 . . . . 0.0 111.634 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -84.81 -9.33 58.27 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 120.921 0.391 . . . . 0.0 110.85 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 48.9 m80 -88.83 -8.01 55.12 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 121.389 0.614 . . . . 0.0 109.557 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.779 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -106.17 140.97 22.54 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 N-CA-C 105.664 -1.976 . . . . 0.0 105.664 177.456 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.711 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -107.18 158.47 17.07 Favored 'General case' 0 C--N 1.276 -2.624 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -51.4 -41.49 60.76 Favored 'General case' 0 N--CA 1.438 -1.034 0 O-C-N 125.352 1.657 . . . . 0.0 109.993 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 18.7 m-20 -69.34 -39.35 78.21 Favored 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.04 179.036 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.572 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -63.62 -50.53 68.99 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 -179.568 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.711 ' HG2' ' O ' ' A' ' 11' ' ' THR 0.261 17.3 mmm-85 -51.54 -57.92 7.74 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 123.642 0.589 . . . . 0.0 109.704 175.978 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.0 t -66.02 -26.84 67.71 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.829 -171.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.422 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 11.0 t60 -70.54 -46.93 62.66 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.724 HD23 HD21 ' A' ' 68' ' ' LEU . 4.3 mp -68.12 -38.84 82.67 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.761 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 15' ' ' ARG . 73.7 t -56.76 -48.44 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 C-N-CA 123.618 0.767 . . . . 0.0 110.114 174.436 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -56.84 -49.01 76.71 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.682 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.579 ' HZ3' HG13 ' B' ' 145' ' ' ILE . 84.2 mttt -63.43 -39.83 95.52 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.769 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.482 ' O ' HG22 ' A' ' 26' ' ' ILE . 5.7 mt -51.01 -52.84 38.9 Favored 'General case' 0 CA--C 1.506 -0.75 0 O-C-N 123.99 0.806 . . . . 0.0 110.577 174.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.65 HG11 ' HE1' ' A' ' 40' ' ' MET . 59.3 t -55.54 -51.24 60.0 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.17 0 O-C-N 124.031 0.832 . . . . 0.0 110.38 176.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -54.62 -35.94 63.96 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -175.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.519 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.2 -45.54 16.18 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 178.01 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.545 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.97 -23.84 15.05 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 CA-C-O 122.251 1.024 . . . . 0.0 110.925 -174.834 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.545 ' CD2' HG23 ' A' ' 26' ' ' ILE . 63.0 m-85 -134.32 94.57 17.52 Favored Pre-proline 0 C--N 1.282 -2.358 0 C-N-CA 124.85 1.26 . . . . 0.0 107.735 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.96 89.54 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 121.906 1.737 . . . . 0.0 110.655 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.441 HG21 HD21 ' A' ' 35' ' ' LEU . 14.5 t -59.3 128.96 86.29 Favored Pre-proline 0 N--CA 1.429 -1.49 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.307 -174.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -73.78 -17.75 22.62 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 123.082 2.521 . . . . 0.0 112.059 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -160.13 146.36 11.86 Favored Pre-proline 0 CA--C 1.492 -1.282 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -61.35 -19.01 62.35 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 121.997 1.798 . . . . 0.0 113.913 176.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.05 -11.84 59.74 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.5 -0.88 . . . . 0.0 111.818 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.05 -6.61 53.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.862 0.839 . . . . 0.0 109.523 175.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.484 ' O ' ' HG2' ' A' ' 40' ' ' MET . 24.6 mt -91.36 0.9 57.45 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.059 -178.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -133.3 18.8 4.01 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 122.195 0.998 . . . . 0.0 108.63 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.587 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 27.9 t70 -96.29 177.18 5.79 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 113.811 -1.541 . . . . 0.0 112.041 -173.537 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.587 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.96 -25.11 62.58 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 124.203 1.001 . . . . 0.0 111.058 179.173 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.589 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 43.0 ttm180 -76.11 -27.84 57.25 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 176.306 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.839 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 10.7 tpp -59.02 -36.64 75.3 Favored 'General case' 0 C--O 1.197 -1.675 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.167 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 9.4 pt-20 -59.24 -32.97 70.46 Favored 'General case' 0 C--O 1.189 -2.103 0 C-N-CA 119.558 -0.857 . . . . 0.0 109.952 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -76.57 -43.33 39.32 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 123.23 0.612 . . . . 0.0 110.465 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.0 mt -63.26 -48.62 77.44 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.199 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.839 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.3 p -73.28 -28.33 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.719 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.137 -178.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -59.81 -45.67 91.64 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.249 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.58 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 13.0 t80 -61.79 -47.86 83.23 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.917 174.469 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.06 -43.05 91.67 Favored 'General case' 0 C--O 1.203 -1.372 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.234 -178.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -66.06 -39.96 90.51 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 123.7 0.8 . . . . 0.0 112.181 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -69.84 -37.36 76.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.359 0.599 . . . . 0.0 109.712 -178.287 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.414 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 65.3 t -70.98 -50.0 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.101 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.404 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.5 tm-20 -57.11 -46.79 82.33 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.964 0.906 . . . . 0.0 109.575 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.67 -40.47 98.04 Favored Glycine 0 CA--C 1.507 -0.413 0 O-C-N 123.587 0.555 . . . . 0.0 112.235 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -59.66 -54.34 47.58 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 122.785 0.434 . . . . 0.0 110.799 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.518 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.99 -34.17 77.81 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 178.118 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.571 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 68.1 t80 -59.48 -52.74 64.28 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 174.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.84 -18.55 61.44 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-O 121.705 0.764 . . . . 0.0 111.837 -179.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.464 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 17.4 m -85.46 -27.16 25.89 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -87.55 167.23 14.12 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -176.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.8 p30 -108.6 5.83 25.37 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.641 177.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.519 ' HB2' ' OD1' ' A' ' 62' ' ' ASP . 42.0 p -169.87 154.33 5.22 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 178.494 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.779 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -62.46 -36.24 81.82 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-O 121.247 0.546 . . . . 0.0 110.51 179.859 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.519 ' OD1' ' HB2' ' A' ' 60' ' ' SER . 1.2 p-10 -62.79 -38.62 91.4 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 124.548 1.139 . . . . 0.0 111.202 177.236 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -70.57 -44.35 67.58 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.705 0.288 . . . . 0.0 110.874 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.454 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -66.28 -43.83 85.26 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.331 -177.97 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.64 -40.11 93.72 Favored 'General case' 0 C--O 1.199 -1.566 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.514 176.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -60.2 -57.73 11.57 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.238 0.336 . . . . 0.0 111.633 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.518 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.7 pp -69.1 -30.43 68.72 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.717 -174.006 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.724 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -76.08 -32.57 59.31 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 119.85 -0.74 . . . . 0.0 109.073 178.366 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.527 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -66.47 -36.8 83.66 Favored 'General case' 0 C--O 1.206 -1.234 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.37 -44.14 92.34 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.757 177.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.517 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.96 -39.05 79.71 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 119.966 -0.694 . . . . 0.0 111.137 179.011 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.527 HG22 ' HA ' ' A' ' 69' ' ' ALA . 10.5 tt -68.91 -40.61 81.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.302 -179.437 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.558 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.1 t80 -57.49 -51.22 70.33 Favored 'General case' 0 C--O 1.261 1.669 0 C-N-CA 124.711 1.204 . . . . 0.0 111.303 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.53 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.8 ptpt -63.53 -40.6 97.44 Favored 'General case' 0 C--O 1.199 -1.565 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.519 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.5 mp -60.7 -38.77 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 O-C-N 123.717 0.636 . . . . 0.0 111.01 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.526 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 28.1 mt-30 -69.26 -45.0 70.8 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 120.265 -0.574 . . . . 0.0 111.855 -177.57 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.583 ' HA ' ' HG2' ' A' ' 80' ' ' GLU . 10.9 ptpt -74.35 -27.6 60.75 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 118.858 -1.137 . . . . 0.0 112.362 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 7.1 tp10 -61.02 -49.2 78.38 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 174.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.591 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.5 pp -65.9 -42.13 90.63 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -177.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.583 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 9.6 pt-20 -69.48 -39.18 77.81 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 119.444 -0.903 . . . . 0.0 112.652 -177.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -69.44 -39.59 77.73 Favored 'General case' 0 C--O 1.213 -0.817 0 C-N-CA 118.877 -1.129 . . . . 0.0 110.534 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.552 ' HD3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -69.25 -31.66 70.35 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 120.564 -0.454 . . . . 0.0 111.016 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.42 ' HG2' ' HE2' ' A' ' 82' ' ' LYS . 5.5 mmt180 . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.913 178.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.591 HD21 ' HB3' ' A' ' 79' ' ' LEU . 56.0 tp . . . . . 0 C--O 1.208 -1.123 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.552 HD13 ' HD3' ' A' ' 82' ' ' LYS . 61.8 tp -71.22 -38.4 72.0 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.372 -0.83 . . . . 0.0 110.463 178.263 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 3.1 t -71.32 -35.84 71.37 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 119.834 -0.746 . . . . 0.0 111.644 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.1 p -69.84 -33.33 72.15 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.595 0.712 . . . . 0.0 109.874 175.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 11.9 t70 . . . . . 0 C--N 1.318 -0.794 0 C-N-CA 124.621 1.168 . . . . 0.0 109.976 176.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.592 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 21.1 ttt . . . . . 0 C--O 1.204 -1.305 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -34.26 -59.99 0.42 Allowed 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -172.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.4 m -69.22 -38.3 78.48 Favored 'General case' 0 C--O 1.253 1.247 0 CA-C-O 121.587 0.708 . . . . 0.0 110.43 -176.226 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 58.6 mt -69.94 -46.77 72.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.415 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.592 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 0.0 OUTLIER -63.56 -36.65 77.16 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.76 -179.051 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -61.4 -65.41 0.7 Allowed 'General case' 0 N--CA 1.428 -1.575 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.395 178.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.2 p -64.2 -54.02 40.08 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -173.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -80.78 -35.14 33.56 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -173.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.466 HD21 HD13 ' A' ' 72' ' ' ILE . 10.1 tt . . . . . 0 N--CA 1.441 -0.917 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -171.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.429 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 10.8 ptpt . . . . . 0 N--CA 1.444 -0.744 0 CA-C-O 121.557 0.694 . . . . 0.0 110.772 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.18 -22.28 13.6 Favored Glycine 0 CA--C 1.521 0.44 0 CA-C-N 114.338 -1.301 . . . . 0.0 115.83 -175.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.429 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 56.9 p-90 -64.37 -9.41 17.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 117.734 0.767 . . . . 0.0 112.279 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -62.58 -17.04 59.27 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 122.382 0.273 . . . . 0.0 111.621 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -86.44 -10.5 54.1 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.268 0.556 . . . . 0.0 110.359 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.414 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 24.7 m-70 -87.98 5.94 38.33 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.68 0.752 . . . . 0.0 109.575 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.606 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -133.51 114.01 19.86 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.703 0 N-CA-C 105.285 -2.117 . . . . 0.0 105.285 178.564 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.72 174.74 7.84 Favored 'General case' 0 C--N 1.276 -2.592 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -63.05 -28.79 70.33 Favored 'General case' 0 C--O 1.202 -1.399 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -57.72 -48.25 80.11 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 178.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.553 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -66.4 -54.45 24.21 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -175.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.541 ' O ' HG23 ' A' ' 19' ' ' VAL . 2.8 ptm180 -60.9 -45.16 95.7 Favored 'General case' 0 N--CA 1.42 -1.956 0 CA-C-N 114.629 -1.169 . . . . 0.0 113.996 -178.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.1 t -65.3 -30.35 71.2 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 117.816 0.28 . . . . 0.0 110.756 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -66.31 -45.16 81.27 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.834 HD23 HD21 ' A' ' 68' ' ' LEU . 6.3 mp -66.33 -40.23 89.75 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.497 178.348 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.5 t -58.98 -49.75 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 124.022 0.929 . . . . 0.0 110.271 175.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -54.84 -44.13 73.66 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.969 0.908 . . . . 0.0 110.04 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -67.96 -41.64 82.14 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.103 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.452 ' O ' HG22 ' A' ' 26' ' ' ILE . 55.5 mt -51.91 -48.03 64.36 Favored 'General case' 0 CA--C 1.501 -0.909 0 O-C-N 123.515 0.509 . . . . 0.0 110.025 175.623 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.514 HG11 ' HE1' ' A' ' 40' ' ' MET . 41.8 t -55.81 -55.42 17.91 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.881 0 O-C-N 124.284 0.99 . . . . 0.0 110.471 175.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -57.21 -29.7 63.95 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -176.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.401 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -81.48 -45.91 15.3 Favored 'General case' 0 C--O 1.21 -1.007 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 176.468 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.452 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.86 -26.31 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-O 121.961 0.886 . . . . 0.0 110.141 -174.461 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.509 ' CG ' HD22 ' A' ' 43' ' ' LEU . 14.4 m-85 -138.81 88.09 14.07 Favored Pre-proline 0 N--CA 1.418 -2.058 0 C-N-CA 125.394 1.477 . . . . 0.0 108.717 177.147 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -57.09 106.33 0.22 Allowed 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 121.74 1.626 . . . . 0.0 109.214 177.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.0 t -66.85 130.08 94.0 Favored Pre-proline 0 N--CA 1.422 -1.833 0 CA-C-O 121.161 0.505 . . . . 0.0 111.164 -174.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.91 -31.6 12.42 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.534 2.156 . . . . 0.0 111.696 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -144.81 148.1 37.94 Favored Pre-proline 0 CA--C 1.49 -1.344 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 -176.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -69.12 -12.98 35.44 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.566 1.511 . . . . 0.0 112.286 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.64 -14.53 48.35 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.408 177.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.83 -11.19 60.5 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.877 0.846 . . . . 0.0 109.037 176.028 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.448 ' HA ' ' CE ' ' A' ' 40' ' ' MET . 23.9 mt -86.92 5.47 36.9 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.414 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -136.12 6.64 3.11 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.82 -0.55 . . . . 0.0 111.556 173.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.642 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 30.9 t70 -81.31 177.56 8.92 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.698 -176.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.642 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.93 -19.3 62.59 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.566 0.698 . . . . 0.0 110.468 175.225 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.62 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 17.3 tpp180 -70.3 -31.94 69.5 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.572 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -57.95 -41.01 81.95 Favored 'General case' 0 CA--C 1.478 -1.803 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.149 -179.424 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 7.7 pt-20 -60.15 -33.98 72.91 Favored 'General case' 0 C--O 1.208 -1.122 0 O-C-N 123.785 0.678 . . . . 0.0 110.763 -175.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -73.6 -44.66 56.58 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.38 0.609 . . . . 0.0 109.901 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 8.8 mt -65.53 -45.73 82.35 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.262 -176.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 40' ' ' MET . 29.1 m -69.33 -31.45 49.6 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.139 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.205 178.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.56 -45.2 89.48 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 177.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.52 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.4 t80 -63.17 -48.6 77.72 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.57 0.544 . . . . 0.0 110.373 173.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.83 -42.04 88.29 Favored 'General case' 0 C--O 1.201 -1.499 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.188 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -68.36 -41.12 81.1 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 123.843 0.857 . . . . 0.0 111.669 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.52 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 57.3 pttt -67.06 -39.33 86.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.728 0.775 . . . . 0.0 109.546 -178.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.466 HG21 ' CE2' ' A' ' 46' ' ' TYR . 42.9 t -72.54 -45.9 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.14 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.7 tm-20 -58.02 -47.53 82.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 177.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.89 -39.35 95.38 Favored Glycine 0 N--CA 1.449 -0.48 0 O-C-N 123.646 0.591 . . . . 0.0 112.436 178.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -59.09 -54.26 49.03 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 123.703 0.801 . . . . 0.0 110.741 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.484 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.4 OUTLIER -69.98 -28.33 65.45 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 178.123 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -66.25 -47.55 73.4 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -73.48 -26.4 60.89 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.187 0.517 . . . . 0.0 111.334 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.484 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 25.6 m -75.89 -33.04 59.92 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.27 170.39 15.45 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.432 0.634 . . . . 0.0 112.237 -178.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -120.18 13.15 11.98 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.423 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.8 p -166.86 152.85 8.15 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.606 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -64.75 -27.4 68.87 Favored 'General case' 0 C--O 1.204 -1.328 0 C-N-CA 118.43 -1.308 . . . . 0.0 110.22 175.328 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -63.07 -47.71 81.75 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.78 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.1 -44.27 89.36 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.317 176.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.408 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.83 -45.35 86.51 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.583 -177.046 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.54 -41.99 98.16 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.215 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.4 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 43.6 t-80 -60.66 -52.69 64.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 70' ' ' GLU . 4.5 pp -72.04 -33.74 68.22 Favored 'General case' 0 C--O 1.264 1.848 0 CA-C-O 121.305 0.574 . . . . 0.0 111.969 -175.597 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.834 HD21 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -70.76 -36.5 73.13 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 179.2 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.549 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -60.94 -39.87 91.08 Favored 'General case' 0 C--O 1.188 -2.151 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.316 175.282 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 42.5 mm-40 -55.77 -51.37 67.64 Favored 'General case' 0 C--O 1.253 1.282 0 C-N-CA 122.697 0.399 . . . . 0.0 111.704 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.81 -39.01 76.79 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 118.63 -1.228 . . . . 0.0 111.924 -177.486 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.549 HG22 ' HA ' ' A' ' 69' ' ' ALA . 8.4 tt -67.65 -45.19 85.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.662 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.556 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 47.7 t80 -54.95 -51.88 64.75 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 125.571 1.548 . . . . 0.0 110.684 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.405 ' NZ ' ' HB3' ' A' ' 74' ' ' LYS . 0.4 OUTLIER -63.21 -41.22 99.12 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 120.471 -0.492 . . . . 0.0 110.53 -179.387 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.401 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.3 mp -62.83 -35.05 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 O-C-N 123.177 0.298 . . . . 0.0 111.45 178.789 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.525 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 5.1 mt-30 -70.75 -44.29 67.08 Favored 'General case' 0 CA--C 1.483 -1.634 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.867 -177.457 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.556 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 12.4 ptpt -74.55 -27.4 60.5 Favored 'General case' 0 N--CA 1.418 -2.027 0 C-N-CA 119.017 -1.073 . . . . 0.0 111.898 176.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HA ' ' HG2' ' A' ' 81' ' ' GLU . 25.4 tt0 -67.46 -42.71 82.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 176.428 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.64 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.5 pp -65.98 -39.34 90.27 Favored 'General case' 0 C--O 1.212 -0.878 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.088 177.426 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -58.4 -52.72 64.44 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 123.726 0.641 . . . . 0.0 111.111 176.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.415 ' HG2' ' HA ' ' A' ' 78' ' ' GLU . 10.8 pt-20 -64.41 -43.23 95.02 Favored 'General case' 0 C--O 1.211 -0.926 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.982 -178.174 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.409 ' C ' ' HD2' ' A' ' 82' ' ' LYS . 0.2 OUTLIER -67.4 -33.47 75.25 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.122 0.486 . . . . 0.0 110.677 -177.799 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.622 -179.017 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.64 HD21 ' HB3' ' A' ' 79' ' ' LEU . 26.5 tp . . . . . 0 N--CA 1.448 -0.563 0 CA-C-O 121.259 0.552 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 40.2 tp -70.12 -33.42 71.81 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 32.3 m -64.64 -43.09 94.8 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 174.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 117' ' ' SER . . . . . 0.408 ' HB3' ' HA ' ' A' ' 27' ' ' PHE . 17.6 m -61.58 -41.99 98.2 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.429 0.633 . . . . 0.0 109.761 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.4 t70 . . . . . 0 C--N 1.323 -0.552 0 C-N-CA 124.144 0.977 . . . . 0.0 110.788 176.867 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.409 ' HE2' ' HB ' ' B' ' 145' ' ' ILE . 16.0 ptm . . . . . 0 C--O 1.209 -1.049 0 N-CA-C 111.157 0.058 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -10.4 -74.18 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 128.196 2.598 . . . . 0.0 115.554 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 5.7 m -66.54 -47.48 72.74 Favored 'General case' 0 C--O 1.253 1.251 0 C-N-CA 123.589 0.756 . . . . 0.0 112.191 -175.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 62.5 mt -65.62 -44.49 93.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.887 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.409 ' HB ' ' HE2' ' B' ' 141' ' ' MET . 12.0 tt -67.49 -36.63 76.92 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.481 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.855 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 45.6 ttt180 -55.71 -50.5 70.14 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.9 m -60.97 -51.86 67.46 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.651 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -76.52 -43.32 39.88 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -174.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.519 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 2.5 tm? . . . . . 0 C--N 1.296 -1.741 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.721 -172.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.453 ' HD2' ' HE1' ' A' ' 6' ' ' TRP . 28.8 mtmm . . . . . 0 N--CA 1.426 -1.65 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -52.2 -25.1 17.56 Favored Glycine 0 C--O 1.243 0.709 0 N-CA-C 116.023 1.169 . . . . 0.0 116.023 -172.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.453 ' HE1' ' HD2' ' A' ' 4' ' ' LYS . 66.2 p-90 -66.59 -14.72 62.75 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 117.412 0.606 . . . . 0.0 112.009 178.542 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -59.39 -14.12 10.92 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 177.12 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -84.86 -10.26 57.31 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.46 0.648 . . . . 0.0 110.422 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -95.04 3.58 54.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.211 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.0 p -134.74 125.85 46.75 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.021 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.459 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -93.84 157.83 15.94 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.52 -177.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -52.42 -43.05 64.6 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.071 0.948 . . . . 0.0 110.049 175.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.415 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 1.9 m-20 -57.47 -37.23 72.55 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.245 -0.888 . . . . 0.0 112.191 -179.083 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.479 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -70.4 -51.45 29.48 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 -176.483 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.497 ' O ' HG23 ' A' ' 19' ' ' VAL . 3.9 ptm180 -66.17 -43.73 86.08 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.447 -1.251 . . . . 0.0 113.164 -176.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.5 t -68.42 -24.46 64.74 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-O 121.181 0.515 . . . . 0.0 109.672 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 20.2 t60 -68.92 -44.58 72.84 Favored 'General case' 0 C--O 1.246 0.915 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 176.282 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.766 HD23 HD21 ' A' ' 68' ' ' LEU . 3.7 mp -65.78 -40.65 92.2 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.705 -1.134 . . . . 0.0 110.171 177.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 15' ' ' ARG . 60.6 t -55.69 -48.46 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.602 0.761 . . . . 0.0 110.101 174.245 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -53.65 -50.43 65.78 Favored 'General case' 0 C--O 1.249 1.053 0 C-N-CA 123.622 0.769 . . . . 0.0 110.607 177.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -64.14 -39.8 94.8 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.814 178.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.522 ' O ' HG22 ' A' ' 26' ' ' ILE . 20.2 mt -50.96 -53.34 33.87 Favored 'General case' 0 CA--C 1.505 -0.782 0 O-C-N 123.797 0.686 . . . . 0.0 110.559 175.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.461 HG11 ' HE1' ' A' ' 40' ' ' MET . 54.7 t -54.8 -50.11 63.77 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.766 0 O-C-N 124.173 0.921 . . . . 0.0 110.786 176.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -55.34 -38.79 69.23 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -177.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.443 ' HB3' HG13 ' A' ' 72' ' ' ILE . . . -81.16 -44.56 17.7 Favored 'General case' 0 C--O 1.206 -1.235 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.834 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.597 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.22 -25.92 16.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.529 0.681 . . . . 0.0 110.725 -175.0 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.597 ' CD2' HG23 ' A' ' 26' ' ' ILE . 62.9 m-85 -128.54 91.51 43.41 Favored Pre-proline 0 C--N 1.293 -1.888 0 C-N-CA 123.858 0.863 . . . . 0.0 109.446 178.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.84 97.52 0.18 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 122.081 1.854 . . . . 0.0 110.172 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.6 t -69.73 138.37 88.17 Favored Pre-proline 0 N--CA 1.424 -1.762 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.512 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.53 -34.99 8.63 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 122.515 2.143 . . . . 0.0 111.376 178.158 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -142.92 150.84 54.58 Favored Pre-proline 0 CA--C 1.489 -1.381 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -65.82 -13.39 39.6 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.1 1.866 . . . . 0.0 112.088 175.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.4 -9.71 55.76 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.369 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.37 -8.77 59.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.378 1.085 . . . . 0.0 108.564 176.087 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.426 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.2 mt -85.6 1.57 48.61 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 114.033 -1.439 . . . . 0.0 110.291 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -133.32 20.07 4.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 122.2 1.0 . . . . 0.0 108.699 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.688 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 27.1 t70 -98.03 177.09 5.53 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.642 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.688 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -68.69 -29.03 67.38 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.725 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.582 ' O ' HD13 ' A' ' 43' ' ' LEU . 4.3 tpm_? -63.95 -34.45 78.0 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.653 ' HA ' HD22 ' A' ' 43' ' ' LEU . 5.9 tpp -58.54 -32.73 69.15 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 114.266 -1.334 . . . . 0.0 112.724 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -64.36 -31.61 72.89 Favored 'General case' 0 C--O 1.203 -1.358 0 C-N-CA 118.727 -1.189 . . . . 0.0 109.845 -178.686 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -72.77 -46.08 55.24 Favored 'General case' 0 CA--C 1.5 -0.949 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 175.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.653 HD22 ' HA ' ' A' ' 40' ' ' MET . 1.7 mp -53.19 -55.97 20.04 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 113.928 -1.487 . . . . 0.0 110.744 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.617 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.0 p -73.26 -29.08 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.034 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.571 -175.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.79 -47.67 84.78 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.534 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.0 t80 -61.15 -46.56 90.01 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.148 175.072 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.48 -44.45 93.04 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 120.854 -0.339 . . . . 0.0 111.21 -177.109 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -62.83 -46.24 88.83 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 123.32 0.648 . . . . 0.0 111.829 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.5 pttp -63.55 -41.84 98.41 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-O 121.306 0.574 . . . . 0.0 110.605 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.512 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 50.8 t -70.47 -43.56 77.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.053 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -58.48 -44.6 89.4 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.7 -42.49 96.34 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.179 178.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.35 -54.62 44.66 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.491 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -67.02 -30.21 70.24 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 179.612 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.6 -50.74 63.98 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -69.4 -25.12 63.98 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.246 -0.434 . . . . 0.0 112.07 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.464 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 34.5 m -79.18 -27.25 42.63 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 124.408 1.083 . . . . 0.0 113.431 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.19 162.82 16.47 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -110.71 8.32 22.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.54 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.6 p -162.49 157.97 23.02 Favored 'General case' 0 CA--C 1.487 -1.452 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 174.586 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.1 -26.45 62.15 Favored 'General case' 0 C--O 1.2 -1.515 0 C-N-CA 118.921 -1.112 . . . . 0.0 110.131 178.676 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -64.72 -45.3 87.13 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.502 176.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -63.26 -44.56 94.81 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.022 175.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -46.45 79.18 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.694 -177.222 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.86 -44.79 96.12 Favored 'General case' 0 C--O 1.209 -1.056 0 O-C-N 123.839 0.712 . . . . 0.0 110.318 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.479 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 13.8 t60 -65.46 -47.16 77.09 Favored 'General case' 0 C--O 1.209 -1.038 0 O-C-N 123.157 0.286 . . . . 0.0 111.475 -177.571 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.477 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.0 pp -70.5 -33.23 70.98 Favored 'General case' 0 C--O 1.255 1.381 0 C-N-CA 120.256 -0.578 . . . . 0.0 111.528 -176.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.766 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -73.23 -33.6 65.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 178.617 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.594 ' O ' ' HB2' ' A' ' 73' ' ' TYR . . . -63.7 -41.97 98.04 Favored 'General case' 0 C--O 1.183 -2.439 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.906 175.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 38.3 mm-40 -57.11 -47.37 81.25 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-O 121.462 0.649 . . . . 0.0 111.314 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.504 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -70.23 -38.62 75.26 Favored 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.908 -178.149 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.524 HG22 ' HA ' ' A' ' 69' ' ' ALA . 9.4 tt -69.68 -36.57 71.0 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-O 121.765 0.793 . . . . 0.0 109.794 -179.154 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.594 ' HB2' ' O ' ' A' ' 69' ' ' ALA . 16.9 t80 -58.55 -55.44 34.99 Favored 'General case' 0 C--O 1.279 2.646 0 C-N-CA 126.656 1.983 . . . . 0.0 109.826 -178.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.7 ptpt -64.87 -33.14 75.29 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.793 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -68.11 -41.79 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 O-C-N 123.481 0.488 . . . . 0.0 111.905 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.574 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 29.1 mt-30 -62.42 -49.01 77.17 Favored 'General case' 0 C--O 1.262 1.745 0 CA-C-O 121.198 0.523 . . . . 0.0 111.253 -178.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.2 ptpt -69.33 -31.18 69.46 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 118.75 -1.18 . . . . 0.0 111.848 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 11.4 tp10 -64.99 -47.53 77.19 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.409 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.602 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.5 pp -60.4 -43.72 96.41 Favored 'General case' 0 CA--C 1.492 -1.285 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.493 -177.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.427 ' N ' HD12 ' A' ' 79' ' ' LEU . 11.5 pt-20 -67.1 -39.15 86.66 Favored 'General case' 0 C--O 1.258 1.52 0 C-N-CA 119.35 -0.94 . . . . 0.0 112.214 -178.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -73.8 -39.26 64.23 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 119.892 -0.723 . . . . 0.0 112.211 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.493 ' HD2' ' C ' ' A' ' 82' ' ' LYS . 0.2 OUTLIER -73.44 -31.93 64.1 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 110.971 -179.429 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 . . . . . 0 CA--C 1.506 -0.74 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.118 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 79' ' ' LEU . 58.3 tp . . . . . 0 C--O 1.233 0.235 0 CA-C-O 120.969 0.414 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 35.0 tp -70.69 -31.05 67.8 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 89.9 m -67.44 -43.04 82.13 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 175.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 15.0 m -57.98 -46.37 85.28 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.708 0.765 . . . . 0.0 110.408 176.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 13.1 t70 . . . . . 0 C--N 1.313 -1.012 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.745 -179.707 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.4 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 5.0 ttt . . . . . 0 C--O 1.168 -3.204 0 N-CA-C 114.52 1.304 . . . . 0.0 114.52 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.481 ' CD ' ' H ' ' B' ' 142' ' ' GLU . 1.6 mp0 -30.14 -65.61 0.11 Allowed 'General case' 0 N--CA 1.503 2.176 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 -170.798 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 9.1 p -68.7 -37.97 79.94 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.407 0.622 . . . . 0.0 111.017 -177.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 42.7 mm -64.39 -48.05 86.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.94 -179.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.4 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 10.0 tp -65.6 -42.04 92.02 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.443 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.356 -176.286 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -62.78 -56.35 18.31 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 119.018 -1.073 . . . . 0.0 111.028 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 25.5 t -62.66 -50.93 69.24 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.519 -173.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -80.67 -37.02 31.58 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -174.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.585 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 2.3 tm? . . . . . 0 CA--C 1.53 0.208 0 CA-C-O 118.444 -0.788 . . . . 0.0 111.699 -175.1 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.5 mttp . . . . . 0 N--CA 1.424 -1.766 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.21 -20.76 44.66 Favored Glycine 0 C--N 1.313 -0.721 0 O-C-N 124.045 0.841 . . . . 0.0 114.533 -174.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -69.58 -8.97 51.96 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 178.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.01 -20.4 66.48 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -80.85 -8.54 59.74 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.265 0.555 . . . . 0.0 110.431 178.554 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -103.54 5.15 36.52 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 121.464 0.649 . . . . 0.0 111.198 -176.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.8 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.9 OUTLIER -122.13 120.43 61.3 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.714 0 N-CA-C 105.132 -2.173 . . . . 0.0 105.132 175.747 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.5 m -74.6 149.7 39.96 Favored 'General case' 0 N--CA 1.407 -2.591 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.1 tm0? -61.27 -38.18 85.83 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.07 -30.72 71.29 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.29 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.468 ' O ' HD13 ' A' ' 18' ' ' LEU . 2.7 tm? -75.45 -53.68 8.28 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.523 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.2 ptm180 -56.44 -44.99 81.01 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 176.458 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.4 t -69.37 -25.86 64.38 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 121.291 -0.163 . . . . 0.0 110.912 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.471 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 30.6 t60 -70.38 -37.11 74.48 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.623 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.602 HD23 HD21 ' A' ' 68' ' ' LEU . 1.7 mp -66.13 -42.72 88.74 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.49 175.09 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.9 t -55.83 -50.72 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.896 0.878 . . . . 0.0 109.878 174.587 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -52.51 -47.15 66.82 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.738 176.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.471 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 61.4 mttm -66.98 -40.15 87.35 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.76 178.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.493 ' O ' HG22 ' A' ' 26' ' ' ILE . 64.9 mt -51.8 -51.06 59.2 Favored 'General case' 0 CA--C 1.506 -0.73 0 O-C-N 123.901 0.751 . . . . 0.0 110.252 175.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.645 HG11 ' HE1' ' A' ' 40' ' ' MET . 78.1 t -54.55 -53.14 33.87 Favored 'Isoleucine or valine' 0 C--O 1.186 -2.283 0 O-C-N 124.164 0.915 . . . . 0.0 110.258 176.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -53.74 -36.41 62.29 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.48 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.79 -45.71 15.22 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 177.276 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.523 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.77 -26.37 16.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.832 0.825 . . . . 0.0 110.49 -174.698 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.523 ' CD2' HG23 ' A' ' 26' ' ' ILE . 50.6 m-85 -130.69 93.52 31.51 Favored Pre-proline 0 C--N 1.285 -2.23 0 C-N-CA 124.187 0.995 . . . . 0.0 109.877 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.438 ' CG ' ' HA ' ' B' ' 118' ' ' ASP . 35.9 Cg_endo -65.88 109.01 1.39 Allowed 'Trans proline' 0 C--O 1.249 1.027 0 C-N-CA 121.7 1.6 . . . . 0.0 109.904 176.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.4 t -76.07 140.14 69.71 Favored Pre-proline 0 N--CA 1.43 -1.426 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.196 -174.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -72.21 -36.2 5.89 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.336 2.024 . . . . 0.0 111.101 176.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -146.97 146.3 25.48 Favored Pre-proline 0 C--N 1.313 -1.001 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 -176.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.41 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 9.9 Cg_endo -55.39 -24.11 41.59 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 122.413 2.076 . . . . 0.0 114.132 175.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.47 -11.49 59.85 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.082 -1.011 . . . . 0.0 111.856 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.0 -9.15 58.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.665 0.745 . . . . 0.0 109.557 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 40' ' ' MET . 18.1 mt -90.15 -5.55 56.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.085 -0.962 . . . . 0.0 110.39 -178.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -133.81 33.16 3.47 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.648 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 32.5 t70 -112.13 176.59 4.96 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 113.76 -1.564 . . . . 0.0 110.65 -173.095 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.648 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.28 -25.59 62.51 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-O 121.196 0.522 . . . . 0.0 110.635 176.89 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.554 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 5.2 tpm_? -71.15 -30.83 66.94 Favored 'General case' 0 C--O 1.252 1.219 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 176.337 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.814 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.5 tpp -58.25 -39.91 80.39 Favored 'General case' 0 C--O 1.197 -1.66 0 CA-C-N 114.483 -1.235 . . . . 0.0 112.683 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.9 pt-20 -59.05 -30.38 68.01 Favored 'General case' 0 C--O 1.205 -1.281 0 C-N-CA 119.521 -0.871 . . . . 0.0 110.919 -177.801 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -74.77 -46.18 38.77 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.287 0.565 . . . . 0.0 109.902 176.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.2 mt -60.2 -51.14 70.86 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.715 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.814 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -71.88 -27.88 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.646 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.376 -178.315 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.49 -46.68 86.19 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.523 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 7.5 t80 -59.76 -47.1 87.02 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.4 174.268 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.49 97.83 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 120.369 -0.533 . . . . 0.0 111.306 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -65.14 -45.81 83.49 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.206 0.602 . . . . 0.0 111.34 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.523 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 56.5 pttt -63.71 -38.04 89.63 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-O 121.726 0.774 . . . . 0.0 110.321 -178.312 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.494 HG21 ' CE1' ' A' ' 46' ' ' TYR . 39.9 t -73.82 -42.84 53.9 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.225 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.134 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.429 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 15.0 tm-20 -58.6 -44.4 89.88 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.55 -43.51 97.55 Favored Glycine 0 CA--C 1.501 -0.783 0 O-C-N 123.626 0.579 . . . . 0.0 111.949 177.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -55.48 -54.36 44.79 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 123.025 0.53 . . . . 0.0 111.718 177.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.48 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -70.76 -29.77 66.09 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -64.64 -49.84 69.43 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 177.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -76.33 -14.23 60.11 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.22 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.1 t -86.77 -17.72 32.84 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.848 0.356 . . . . 0.0 110.106 176.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.43 171.81 8.16 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-O 121.225 0.536 . . . . 0.0 112.045 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -124.02 14.6 9.18 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.723 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 82.5 p -167.9 156.59 9.29 Favored 'General case' 0 CA--C 1.486 -1.505 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 175.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.8 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -67.36 -31.32 71.49 Favored 'General case' 0 C--O 1.189 -2.128 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.625 175.03 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -58.78 -47.88 83.18 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 123.725 0.641 . . . . 0.0 110.499 178.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -65.96 -45.12 82.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.57 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.421 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -66.11 -46.46 77.51 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.856 -176.463 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -60.62 -44.29 96.5 Favored 'General case' 0 C--O 1.204 -1.323 0 C-N-CA 123.831 0.852 . . . . 0.0 109.283 177.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.471 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 7.4 t60 -58.88 -57.32 13.58 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 123.261 0.624 . . . . 0.0 110.925 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.476 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.2 pp -68.03 -33.21 74.16 Favored 'General case' 0 C--O 1.258 1.537 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -173.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.602 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -72.34 -37.78 68.78 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 179.573 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.597 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -60.39 -40.11 89.72 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.552 176.414 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 55.7 mm-40 -60.78 -46.11 91.75 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.01 178.466 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -42.5 75.3 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 118.769 -1.172 . . . . 0.0 111.23 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.518 HG22 ' HA ' ' A' ' 69' ' ' ALA . 5.5 tt -63.13 -42.26 95.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.751 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -57.19 -52.97 63.18 Favored 'General case' 0 C--O 1.274 2.366 0 C-N-CA 125.054 1.342 . . . . 0.0 110.379 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.6 -32.06 73.44 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.571 -178.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.48 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -68.1 -37.12 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 123.007 0.523 . . . . 0.0 111.11 178.206 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.565 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 34.9 mt-30 -65.59 -45.67 82.3 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 121.189 0.519 . . . . 0.0 110.751 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.474 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -70.32 -27.88 64.72 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 118.472 -1.291 . . . . 0.0 113.034 175.605 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -63.44 -48.42 77.81 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 175.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.6 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.7 pp -62.9 -40.46 97.64 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.06 -178.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.433 ' N ' HD12 ' A' ' 79' ' ' LEU . 0.7 OUTLIER -60.39 -53.33 58.9 Favored 'General case' 0 N--CA 1.412 -2.344 0 O-C-N 123.956 0.785 . . . . 0.0 110.467 -179.61 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -72.35 -33.17 67.09 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 118.982 -1.087 . . . . 0.0 112.54 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.426 ' HE3' ' CG ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -67.21 -34.14 76.87 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.396 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.713 178.96 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.6 HD21 ' HB3' ' A' ' 79' ' ' LEU . 36.9 tp . . . . . 0 C--O 1.219 -0.529 0 CA-C-O 120.829 0.347 . . . . 0.0 111.908 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.0 tp -74.89 -44.36 49.27 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 173.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 42.2 m -68.9 -36.68 78.33 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 114.506 -1.224 . . . . 0.0 111.062 -179.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 117' ' ' SER . . . . . 0.546 ' OG ' ' HA ' ' B' ' 114' ' ' LEU . 68.2 p -75.95 -34.98 59.85 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.011 0.434 . . . . 0.0 110.108 178.212 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 20.6 t70 . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 121.597 0.713 . . . . 0.0 109.409 175.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.485 ' O ' HG12 ' B' ' 145' ' ' ILE . 19.4 ttt . . . . . 0 N--CA 1.418 -2.068 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 41.3 mt-10 -55.61 -42.25 74.62 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -174.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.4 p -59.26 -51.65 69.06 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.36 0.6 . . . . 0.0 110.722 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 41.1 mt -67.3 -47.54 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.686 -177.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.485 HG12 ' O ' ' B' ' 141' ' ' MET . 40.4 pt -66.32 -31.19 52.5 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.141 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.714 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 146' ' ' ARG . . . . . 0.535 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 91.2 mtt180 -68.97 -53.15 22.3 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 118.423 -1.311 . . . . 0.0 108.883 177.014 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 47.6 t -60.67 -54.96 38.92 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.403 -177.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -82.4 -41.49 19.85 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 -178.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.597 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 9.4 tt . . . . . 0 C--N 1.3 -1.572 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -166.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.433 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 9.9 ptpt . . . . . 0 N--CA 1.429 -1.485 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.57 -20.16 1.55 Allowed Glycine 0 N--CA 1.484 1.85 0 N-CA-C 117.121 1.608 . . . . 0.0 117.121 -170.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.433 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 67.2 p-90 -67.84 -16.51 64.13 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 117.462 0.631 . . . . 0.0 111.798 179.074 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -67.72 -9.91 47.86 Favored 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -89.47 -8.05 53.72 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.417 0.627 . . . . 0.0 109.663 176.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -100.04 3.08 43.92 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.634 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.0 p -135.27 113.82 15.97 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.997 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 -177.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 m -96.28 163.75 12.95 Favored 'General case' 0 N--CA 1.419 -2.01 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -176.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.8 tm0? -51.16 -36.43 40.95 Favored 'General case' 0 C--O 1.213 -0.827 0 C-N-CA 124.325 1.05 . . . . 0.0 111.498 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -55.42 -44.81 76.59 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 123.257 0.623 . . . . 0.0 111.807 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.49 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.0 tm? -70.23 -51.14 33.03 Favored 'General case' 0 CA--C 1.492 -1.281 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -175.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.551 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.6 ptm180 -65.52 -40.99 93.59 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 114.505 -1.225 . . . . 0.0 113.091 -175.515 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.2 t -68.18 -28.33 67.18 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -66.5 -43.0 86.53 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.78 HD23 HD21 ' A' ' 68' ' ' LEU . 5.1 mp -67.38 -40.61 85.7 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.033 177.011 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 15' ' ' ARG . 65.2 t -57.6 -49.21 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.7 0.8 . . . . 0.0 110.095 175.089 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -54.49 -45.1 73.17 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.309 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.4 mttm -68.55 -38.32 80.68 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.315 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.475 ' O ' HG22 ' A' ' 26' ' ' ILE . 65.8 mt -54.07 -46.58 72.05 Favored 'General case' 0 C--O 1.214 -0.787 0 O-C-N 123.661 0.601 . . . . 0.0 109.589 174.577 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.664 HG11 ' HE1' ' A' ' 40' ' ' MET . 46.8 t -55.28 -53.43 35.29 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.559 0 O-C-N 124.003 0.815 . . . . 0.0 110.833 174.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -57.32 -30.69 64.99 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.499 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -82.77 -46.91 12.54 Favored 'General case' 0 C--O 1.203 -1.372 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 174.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.481 HG13 ' CE1' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -73.32 -26.57 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 121.799 0.809 . . . . 0.0 110.068 -174.819 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -131.53 91.89 33.11 Favored Pre-proline 0 N--CA 1.405 -2.721 0 C-N-CA 124.438 1.095 . . . . 0.0 108.594 176.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -63.64 93.3 0.17 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.725 1.617 . . . . 0.0 109.202 176.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.415 HG21 HD21 ' A' ' 35' ' ' LEU . 4.8 t -65.82 130.05 94.41 Favored Pre-proline 0 N--CA 1.415 -2.18 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.567 -172.42 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.477 ' HG2' ' OD1' ' A' ' 31' ' ' ASP . 41.8 Cg_endo -73.64 -31.63 8.46 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.588 2.192 . . . . 0.0 111.085 178.547 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.477 ' OD1' ' HG2' ' A' ' 30' ' ' PRO . 6.3 p-10 -144.18 155.4 58.24 Favored Pre-proline 0 N--CA 1.427 -1.622 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.429 -175.504 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.53 ' HA ' HD12 ' A' ' 35' ' ' LEU . 72.5 Cg_endo -75.66 -5.23 16.26 Favored 'Trans proline' 0 N--CA 1.45 -1.068 0 C-N-CA 121.77 1.647 . . . . 0.0 113.351 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -88.54 -24.68 22.84 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.542 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.93 -21.09 63.07 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 122.038 0.923 . . . . 0.0 109.831 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.53 HD12 ' HA ' ' A' ' 32' ' ' PRO . 45.2 mt -80.05 -8.44 59.37 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.24 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -134.2 21.93 3.76 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.215 0.531 . . . . 0.0 109.927 178.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.412 ' O ' ' HB3' ' A' ' 40' ' ' MET . 20.5 t70 -90.11 178.02 6.29 Favored 'General case' 0 N--CA 1.422 -1.862 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.774 ' HD2' ' N ' ' A' ' 39' ' ' ARG . 2.3 ppt_? -63.75 -28.9 70.2 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.774 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 4.5 tpm_? -70.18 -30.19 67.25 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.032 -175.271 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.726 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 6.7 tpp -57.72 -32.17 67.15 Favored 'General case' 0 C--O 1.201 -1.452 0 CA-C-N 114.231 -1.35 . . . . 0.0 112.086 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -61.42 -29.83 70.18 Favored 'General case' 0 C--O 1.18 -2.594 0 C-N-CA 118.111 -1.436 . . . . 0.0 110.918 -179.445 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -75.48 -46.66 31.14 Favored 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 124.024 0.828 . . . . 0.0 109.088 176.032 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 39' ' ' ARG . 5.2 mp -51.63 -56.94 10.72 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 114.299 -1.319 . . . . 0.0 109.894 179.275 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.726 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -73.29 -28.2 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.59 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.517 -177.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -61.53 -43.24 99.22 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.499 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.546 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.9 t80 -65.81 -47.08 76.26 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.61 174.352 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.44 -40.91 88.32 Favored 'General case' 0 C--O 1.2 -1.51 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.829 -176.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.7 -43.07 80.94 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.612 0.765 . . . . 0.0 111.997 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.546 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 57.0 pttt -67.04 -40.25 87.12 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.399 0.619 . . . . 0.0 109.708 -178.089 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.448 HG21 ' CE2' ' A' ' 46' ' ' TYR . 45.7 t -71.53 -47.26 59.23 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.668 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -57.73 -45.65 85.52 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.91 -44.39 94.45 Favored Glycine 0 N--CA 1.436 -1.349 0 O-C-N 124.236 0.96 . . . . 0.0 111.768 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -58.72 -54.19 49.86 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.478 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -65.26 -35.21 80.31 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 178.768 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -62.91 -50.88 69.1 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.644 0.735 . . . . 0.0 109.34 177.411 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.78 -21.75 61.68 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.163 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.7 t -85.28 -42.8 14.3 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -178.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.05 163.52 14.63 Favored 'General case' 0 C--O 1.244 0.797 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.364 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -109.05 2.82 21.46 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.583 -178.596 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.419 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 48.7 m -161.44 154.29 20.69 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 176.104 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.58 -34.53 74.28 Favored 'General case' 0 C--O 1.196 -1.757 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.184 -178.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.419 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 4.9 p-10 -65.12 -35.83 82.36 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -66.82 -47.84 70.78 Favored 'General case' 0 N--CA 1.455 -0.175 0 O-C-N 123.487 0.492 . . . . 0.0 110.564 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -45.1 89.94 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.252 -177.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -60.65 -46.01 91.92 Favored 'General case' 0 C--O 1.19 -2.063 0 O-C-N 123.978 0.799 . . . . 0.0 109.719 176.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.555 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 28.7 t-80 -60.05 -55.05 38.7 Favored 'General case' 0 C--O 1.208 -1.104 0 O-C-N 123.194 0.309 . . . . 0.0 111.581 -178.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.455 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.1 pp -65.74 -32.55 74.16 Favored 'General case' 0 C--O 1.262 1.746 0 CA-C-O 120.965 0.412 . . . . 0.0 111.47 -175.573 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.78 HD21 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -75.09 -35.83 61.75 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.362 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.633 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.11 -34.84 78.47 Favored 'General case' 0 C--O 1.203 -1.347 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.736 176.645 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.555 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 17.2 mt-10 -69.43 -42.53 74.86 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.467 178.255 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.9 -38.82 83.47 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.393 -0.923 . . . . 0.0 110.891 179.231 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.633 HG22 ' HA ' ' A' ' 69' ' ' ALA . 5.9 tt -66.2 -48.37 81.48 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.853 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.548 177.622 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.454 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 8.3 t80 -51.71 -51.39 56.4 Favored 'General case' 0 C--O 1.269 2.116 0 C-N-CA 124.949 1.3 . . . . 0.0 111.837 178.183 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.8 ptpt -65.03 -38.8 92.06 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.884 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.487 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -64.42 -37.06 79.03 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.654 0 O-C-N 123.557 0.536 . . . . 0.0 111.124 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.663 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.2 mm-40 -59.65 -55.38 35.17 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 122.085 0.945 . . . . 0.0 109.454 178.479 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 1.2 ptpm? -70.19 -27.66 64.68 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.572 178.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.528 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 6.3 tp10 -63.67 -45.84 88.28 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 176.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.7 pp -64.79 -44.83 88.7 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.874 -177.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.464 ' N ' HD12 ' A' ' 79' ' ' LEU . 7.1 pt-20 -68.67 -44.63 73.65 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 119.364 -0.934 . . . . 0.0 112.65 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.6 -40.06 95.73 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.421 -0.511 . . . . 0.0 110.813 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.66 -29.83 62.56 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.403 -178.427 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.035 -179.519 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.612 HD21 ' HB3' ' A' ' 79' ' ' LEU . 47.7 tp . . . . . 0 C--O 1.222 -0.368 0 CA-C-O 121.172 0.511 . . . . 0.0 110.128 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 46.4 tp -69.58 -37.72 77.09 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 18.2 m -63.56 -41.35 98.41 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 14.3 m -63.94 -46.67 83.69 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.417 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 16.2 t70 . . . . . 0 C--N 1.315 -0.919 0 C-N-CA 125.117 1.367 . . . . 0.0 111.135 -177.988 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.587 ' HB2' ' HB ' ' B' ' 145' ' ' ILE . 64.0 mtm . . . . . 0 N--CA 1.435 -1.202 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 29.4 -86.54 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 127.684 2.394 . . . . 0.0 114.432 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.53 -46.95 62.64 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.966 -172.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 47.3 mm -64.42 -47.97 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-N 114.161 -1.381 . . . . 0.0 109.167 -177.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.587 ' HB ' ' HB2' ' B' ' 141' ' ' MET . 15.6 tt -70.01 -31.57 48.26 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.403 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.616 -176.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 27.6 ttm-85 -64.73 -60.6 2.92 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 19.3 p -66.78 -44.04 82.37 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -174.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -80.57 -38.83 28.79 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.478 ' HA ' ' HB1' ' A' ' 69' ' ' ALA 0.267 9.1 tt . . . . . 0 C--N 1.315 -0.892 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -173.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.421 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 42.3 mttp . . . . . 0 N--CA 1.42 -1.975 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.461 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -67.03 -3.92 25.56 Favored Glycine 0 C--N 1.31 -0.889 0 CA-C-N 115.838 -0.619 . . . . 0.0 114.263 -174.166 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.421 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 61.1 p-90 -78.76 -11.84 60.0 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 122.275 -0.544 . . . . 0.0 111.108 177.074 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -59.07 -26.56 64.73 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-O 121.267 0.556 . . . . 0.0 111.233 -178.276 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 12.9 pt-20 -81.89 -4.11 55.77 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -176.113 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -104.52 2.78 31.24 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 120.973 0.416 . . . . 0.0 111.555 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.755 HG22 ' HB3' ' A' ' 61' ' ' ARG . 1.5 t -110.5 110.54 32.55 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.459 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.497 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER -68.9 151.55 46.42 Favored 'General case' 0 N--CA 1.412 -2.373 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -179.15 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -55.03 -41.65 71.62 Favored 'General case' 0 N--CA 1.426 -1.627 0 O-C-N 124.672 1.232 . . . . 0.0 108.796 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.487 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 10.9 m-20 -67.45 -30.52 70.28 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-O 118.866 -0.587 . . . . 0.0 112.534 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.531 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.68 -54.65 7.62 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' A' ' 11' ' ' THR . 1.6 ptm180 -55.14 -48.2 74.02 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 177.027 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.417 ' HA ' ' HB ' ' A' ' 19' ' ' VAL . 40.0 m -72.61 -21.13 61.17 Favored 'General case' 0 N--CA 1.426 -1.664 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.249 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.487 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 10.5 t60 -67.89 -42.43 81.22 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 174.367 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.71 HD23 HD21 ' A' ' 68' ' ' LEU . 3.9 mp -69.84 -40.08 76.05 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.794 178.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.2 t -55.8 -49.72 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 C-N-CA 123.559 0.744 . . . . 0.0 109.942 172.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -53.15 -50.38 64.66 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.264 1.026 . . . . 0.0 110.122 178.258 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -66.73 -38.14 86.08 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.046 179.015 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.493 ' O ' HG22 ' A' ' 26' ' ' ILE . 3.2 mt -51.02 -50.79 57.87 Favored 'General case' 0 CA--C 1.495 -1.152 0 O-C-N 123.924 0.765 . . . . 0.0 109.61 174.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.626 HG11 ' HE1' ' A' ' 40' ' ' MET . 57.8 t -55.56 -52.78 43.56 Favored 'Isoleucine or valine' 0 C--O 1.172 -2.999 0 O-C-N 124.336 1.023 . . . . 0.0 109.771 175.155 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -54.09 -33.29 57.21 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -175.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.549 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -82.01 -46.23 14.24 Favored 'General case' 0 C--O 1.207 -1.175 0 CA-C-O 121.505 0.669 . . . . 0.0 111.597 175.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.579 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -78.55 -23.69 13.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 CA-C-O 122.065 0.936 . . . . 0.0 110.84 -174.082 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.579 ' CD2' HG23 ' A' ' 26' ' ' ILE . 66.1 m-85 -135.31 95.26 14.86 Favored Pre-proline 0 C--N 1.279 -2.47 0 C-N-CA 125.057 1.343 . . . . 0.0 107.491 178.27 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -60.53 95.29 0.11 Allowed 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.287 1.992 . . . . 0.0 112.47 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.448 HG21 HD21 ' A' ' 35' ' ' LEU . 10.0 t -75.27 124.62 89.29 Favored Pre-proline 0 N--CA 1.424 -1.74 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.058 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.39 -29.36 13.85 Favored 'Trans proline' 0 C--O 1.245 0.869 0 C-N-CA 122.402 2.068 . . . . 0.0 111.752 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -141.54 151.72 61.39 Favored Pre-proline 0 CA--C 1.486 -1.496 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -176.382 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.496 ' HA ' HD12 ' A' ' 35' ' ' LEU . 38.1 Cg_endo -71.67 -7.35 21.0 Favored 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 121.587 1.525 . . . . 0.0 111.611 175.072 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.9 -12.9 43.39 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-O 121.318 0.58 . . . . 0.0 110.69 177.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.53 -6.09 54.48 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 122.159 0.98 . . . . 0.0 108.722 175.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.566 ' O ' ' HG2' ' A' ' 40' ' ' MET . 27.6 mt -91.75 6.53 45.59 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.797 -179.199 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -133.07 21.91 4.12 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.619 ' OD1' ' HD3' ' A' ' 38' ' ' ARG . 13.9 t70 -85.16 170.26 13.06 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.695 -1.593 . . . . 0.0 108.449 -178.121 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.619 ' HD3' ' OD1' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.63 -24.74 61.93 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.939 0.876 . . . . 0.0 110.567 178.747 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.618 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 40.3 ttp180 -75.02 -21.2 59.23 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.818 -1.083 . . . . 0.0 109.109 178.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.768 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.2 tpp -60.67 -34.26 74.05 Favored 'General case' 0 C--O 1.207 -1.155 0 CA-C-N 115.124 -0.943 . . . . 0.0 112.413 -179.189 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.36 -31.24 71.86 Favored 'General case' 0 C--O 1.197 -1.689 0 C-N-CA 117.748 -1.581 . . . . 0.0 110.711 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -74.31 -46.49 40.7 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 121.393 0.616 . . . . 0.0 109.712 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.3 mt -59.78 -49.63 76.97 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.578 -179.052 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.768 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.6 p -73.3 -27.68 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.577 -178.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.31 -47.06 86.83 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 177.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.538 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 16.6 t80 -62.91 -45.69 91.34 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.068 174.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.66 94.12 Favored 'General case' 0 C--O 1.203 -1.352 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.216 -177.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -62.85 -44.79 95.19 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 123.29 0.636 . . . . 0.0 111.327 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.538 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 53.9 pttt -66.64 -36.49 82.7 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.645 0.736 . . . . 0.0 110.702 -177.69 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.509 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 69.4 t -75.23 -42.68 44.18 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.668 178.631 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.77 -43.3 90.33 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.23 -43.44 98.46 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.502 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.406 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 21.3 t70 -53.93 -51.97 62.08 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.257 0.623 . . . . 0.0 111.373 178.142 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.474 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -74.28 -27.6 60.81 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 179.66 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -63.86 -49.86 71.08 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 176.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -73.18 -22.63 60.44 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.979 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.3 t -81.37 -13.6 58.14 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.136 178.233 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.26 169.58 9.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.532 0.682 . . . . 0.0 112.487 -178.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -119.13 6.38 11.27 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.468 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.9 m -164.94 147.37 8.2 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.755 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -55.87 -40.39 72.87 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 175.343 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -56.17 -46.13 79.44 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.229 0.537 . . . . 0.0 110.139 178.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.65 -46.42 82.59 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.153 178.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -44.06 92.95 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 123.366 0.416 . . . . 0.0 109.994 -177.695 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -59.83 -47.58 85.15 Favored 'General case' 0 C--O 1.201 -1.45 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.631 175.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -62.31 -48.42 79.95 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -177.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.474 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.9 pp -71.97 -30.69 65.53 Favored 'General case' 0 C--O 1.258 1.507 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.273 -175.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.71 HD21 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -75.77 -33.6 60.2 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.554 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -62.07 -40.12 94.72 Favored 'General case' 0 C--O 1.198 -1.607 0 CA-C-N 115.03 -0.986 . . . . 0.0 108.781 176.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.87 -46.46 87.76 Favored 'General case' 0 C--O 1.259 1.58 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.932 177.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.77 -40.82 88.35 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.168 179.646 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 7.8 tt -67.08 -44.76 87.93 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.228 -178.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -52.64 -49.5 65.03 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 125.869 1.668 . . . . 0.0 111.215 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -69.18 -33.26 73.1 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.442 -179.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.549 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.5 mp -66.28 -39.28 83.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 116.772 -0.194 . . . . 0.0 110.707 175.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.592 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 22.5 mm-40 -58.62 -48.54 80.66 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.306 0.575 . . . . 0.0 109.491 178.427 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.735 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS 0.252 0.0 OUTLIER -69.5 -33.35 72.72 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 175.917 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -59.37 -45.92 90.1 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 176.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.4 pp -67.36 -39.71 85.73 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.459 -179.036 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.581 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 14.6 pt-20 -63.74 -45.16 91.16 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.04 0.382 . . . . 0.0 110.457 -178.15 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.57 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.7 pt-20 -76.01 -37.8 58.02 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.147 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -33.34 72.92 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.034 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 28.9 tpt180 . . . . . 0 N--CA 1.467 0.421 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.312 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.566 HD21 ' HB3' ' A' ' 79' ' ' LEU . 48.8 tp . . . . . 0 C--O 1.216 -0.67 0 CA-C-O 120.765 0.317 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.16 -42.34 66.02 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 175.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 30.7 m -68.83 -35.59 77.16 Favored 'General case' 0 CA--C 1.553 1.059 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.216 178.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 29.8 m -74.48 -26.64 60.14 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-O 121.36 0.6 . . . . 0.0 110.876 177.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 15.1 t70 . . . . . 0 C--N 1.321 -0.634 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 141' ' ' MET . . . . . 0.559 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 53.4 ttp . . . . . 0 C--O 1.206 -1.203 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -46.51 -58.09 4.1 Favored 'General case' 0 CA--C 1.568 1.646 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 -171.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 10.0 m -65.43 -39.57 92.26 Favored 'General case' 0 C--O 1.264 1.861 0 CA-C-O 121.922 0.868 . . . . 0.0 110.387 -176.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 47.1 mm -67.45 -44.87 86.53 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.133 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.365 -179.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.559 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 18.3 tt -67.82 -31.13 50.88 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-O 120.832 0.349 . . . . 0.0 111.494 -176.695 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -65.31 0.71 Allowed 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.062 171.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.7 p -61.1 -43.11 99.38 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -174.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -81.32 -46.69 14.35 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.554 ' HA ' ' HB1' ' A' ' 69' ' ' ALA 0.279 8.2 tt . . . . . 0 C--N 1.317 -0.829 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -169.138 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.465 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 82.9 mttt . . . . . 0 N--CA 1.428 -1.557 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.58 -22.38 39.01 Favored Glycine 0 N--CA 1.464 0.56 0 O-C-N 123.904 0.752 . . . . 0.0 114.892 -173.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.465 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 68.9 p-90 -74.97 -5.02 41.66 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 122.216 -0.579 . . . . 0.0 112.173 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -61.04 -26.59 67.73 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 117.98 0.354 . . . . 0.0 110.941 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -78.13 -7.05 56.52 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.595 0.712 . . . . 0.0 110.368 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -102.35 3.14 37.65 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.817 -177.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.406 HG23 HD12 ' A' ' 14' ' ' LEU . 6.0 p -136.52 109.55 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.843 0 CA-C-O 122.157 0.98 . . . . 0.0 108.839 -179.213 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.5 m -86.37 155.76 20.47 Favored 'General case' 0 C--N 1.286 -2.162 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.376 -175.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -50.71 -39.47 51.61 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.409 1.084 . . . . 0.0 110.928 177.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -57.43 -41.11 79.8 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 178.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.542 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.1 tm? -69.02 -52.31 30.0 Favored 'General case' 0 CA--C 1.485 -1.543 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -175.019 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.574 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.8 ptm180 -64.5 -44.67 90.22 Favored 'General case' 0 N--CA 1.413 -2.299 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.985 -176.156 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 t -64.21 -29.93 71.01 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.946 0.403 . . . . 0.0 110.038 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -66.18 -45.57 80.39 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.736 HD23 HD21 ' A' ' 68' ' ' LEU . 4.9 mp -66.24 -39.42 89.52 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.739 177.315 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 15' ' ' ARG . 62.2 t -58.15 -50.18 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 124.329 1.052 . . . . 0.0 110.361 175.244 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -54.8 -46.56 74.51 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.483 177.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -65.94 -38.83 89.65 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.848 177.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.513 ' O ' HG22 ' A' ' 26' ' ' ILE . 20.7 mt -52.09 -49.31 63.84 Favored 'General case' 0 CA--C 1.498 -1.033 0 O-C-N 123.859 0.724 . . . . 0.0 110.023 174.541 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.458 HG13 ' HB3' ' A' ' 43' ' ' LEU . 71.2 t -56.62 -52.36 54.64 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.677 0 O-C-N 124.139 0.899 . . . . 0.0 109.825 175.299 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -53.58 -34.5 58.58 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -178.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.5 -45.9 15.3 Favored 'General case' 0 C--O 1.2 -1.539 0 CA-C-O 121.152 0.501 . . . . 0.0 111.917 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.533 HG13 ' CZ ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -75.31 -32.94 26.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-O 121.365 0.602 . . . . 0.0 110.679 -175.05 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.501 ' CD2' HG23 ' A' ' 26' ' ' ILE . 56.4 m-85 -128.56 91.57 43.22 Favored Pre-proline 0 C--N 1.283 -2.284 0 C-N-CA 124.801 1.24 . . . . 0.0 108.256 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.21 96.55 0.34 Allowed 'Trans proline' 0 N--CA 1.447 -1.224 0 C-N-CA 121.51 1.473 . . . . 0.0 110.062 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.8 t -52.64 123.56 31.1 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.879 -176.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.88 -16.88 29.28 Favored 'Trans proline' 0 C--O 1.237 0.451 0 C-N-CA 122.389 2.059 . . . . 0.0 112.27 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -163.39 148.54 9.26 Favored Pre-proline 0 N--CA 1.446 -0.638 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -174.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.43 ' O ' HD12 ' A' ' 35' ' ' LEU . 4.8 Cg_endo -52.57 -27.59 33.3 Favored 'Trans proline' 0 CA--C 1.559 1.749 0 C-N-CA 123.34 2.694 . . . . 0.0 113.172 173.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.63 -11.61 57.05 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 121.133 -0.98 . . . . 0.0 111.813 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.44 -42.1 30.93 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.085 0.469 . . . . 0.0 110.692 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.43 HD12 ' O ' ' A' ' 32' ' ' PRO 0.326 0.3 OUTLIER -75.84 8.51 3.02 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 178.039 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -133.06 17.97 4.11 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.408 0.623 . . . . 0.0 110.263 174.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.574 ' O ' ' HB3' ' A' ' 40' ' ' MET . 36.6 t70 -93.21 -178.38 4.75 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.721 -178.292 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.536 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.91 -22.45 62.25 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.916 -0.49 . . . . 0.0 110.46 179.246 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.571 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 42.3 ttm180 -73.27 -21.9 60.5 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.516 0.674 . . . . 0.0 109.716 176.176 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.657 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.4 tpp -61.55 -34.53 75.72 Favored 'General case' 0 C--O 1.197 -1.704 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.869 177.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.615 ' HA ' HG12 ' A' ' 44' ' ' VAL . 12.9 pt-20 -66.97 -24.86 66.1 Favored 'General case' 0 C--O 1.2 -1.531 0 C-N-CA 118.33 -1.348 . . . . 0.0 110.844 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -74.28 -44.58 52.18 Favored 'General case' 0 C--O 1.249 1.063 0 CA-C-O 121.485 0.659 . . . . 0.0 109.548 174.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.4 mt -63.08 -49.12 75.75 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.504 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.657 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 2.6 p -70.58 -27.89 32.7 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.337 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.685 -178.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.31 96.28 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 176.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.572 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.1 t80 -60.79 -47.76 84.85 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 173.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.81 -43.41 94.53 Favored 'General case' 0 C--O 1.197 -1.709 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.999 -176.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -64.0 -42.39 97.17 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 123.525 0.73 . . . . 0.0 112.06 177.108 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.4 pttp -68.01 -37.09 81.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.489 0.661 . . . . 0.0 110.056 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.486 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 52.9 t -73.06 -49.41 38.93 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.576 178.103 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 13.8 tm-20 -56.62 -46.07 81.16 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 124.112 0.965 . . . . 0.0 109.202 178.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.493 ' O ' ' HG2' ' A' ' 56' ' ' GLU . . . -58.01 -48.19 84.24 Favored Glycine 0 N--CA 1.432 -1.609 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.88 178.307 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -56.71 -51.16 69.87 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.118 0.485 . . . . 0.0 111.781 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.512 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -67.99 -29.62 68.68 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 179.139 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.421 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 65.6 t80 -62.75 -51.52 66.83 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 176.428 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 52' ' ' GLY . 5.9 mm-40 -71.95 -24.48 61.62 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.691 -177.596 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 t -79.55 -22.05 44.33 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.312 0.577 . . . . 0.0 110.183 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -93.15 162.81 13.87 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 121.157 0.504 . . . . 0.0 111.171 -177.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -118.51 19.01 13.45 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.647 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.5 p -167.21 157.2 10.98 Favored 'General case' 0 CA--C 1.488 -1.441 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 171.611 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HA ' ' HD2' ' A' ' 64' ' ' TYR . 0.1 OUTLIER -72.29 -26.1 61.84 Favored 'General case' 0 C--N 1.308 -1.196 0 C-N-CA 119.241 -0.984 . . . . 0.0 111.432 179.135 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -65.53 -47.37 76.15 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.87 -47.31 86.27 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.865 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.416 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -65.19 -46.63 79.97 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.963 -176.892 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 2.4 t80 -60.99 -43.43 98.88 Favored 'General case' 0 C--O 1.203 -1.351 0 O-C-N 123.8 0.687 . . . . 0.0 110.301 178.061 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.436 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 31.8 t-80 -62.88 -54.66 35.24 Favored 'General case' 0 C--O 1.214 -0.789 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.1 pp -65.39 -33.64 76.43 Favored 'General case' 0 C--O 1.272 2.286 0 CA-C-O 121.413 0.625 . . . . 0.0 111.634 -175.472 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.736 HD21 HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -73.79 -35.29 64.9 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.236 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.556 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.78 -34.49 78.02 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.159 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 17.4 mt-10 -68.44 -46.76 69.0 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 120.134 -0.626 . . . . 0.0 110.055 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -64.73 -36.83 85.55 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 119.501 -0.88 . . . . 0.0 111.512 -179.038 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.642 HD13 HD11 ' B' ' 149' ' ' LEU . 8.9 tt -69.31 -47.07 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.576 179.446 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.483 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 23.0 t80 -51.68 -49.94 61.4 Favored 'General case' 0 C--O 1.256 1.427 0 C-N-CA 125.889 1.676 . . . . 0.0 111.063 178.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -67.35 -34.64 77.74 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.679 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.557 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.3 mp -68.79 -34.83 66.68 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 CA-C-O 120.603 0.239 . . . . 0.0 111.086 177.419 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 72' ' ' ILE . 22.1 mm-40 -62.06 -49.52 75.67 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.505 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS . 0.5 OUTLIER -71.92 -31.04 65.97 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 119.656 -0.818 . . . . 0.0 113.088 177.491 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -57.92 -50.35 73.65 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 175.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -64.93 -36.95 86.04 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.379 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 77' ' ' LYS . 3.2 mm-40 -61.01 -53.54 56.01 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.131 0.572 . . . . 0.0 111.612 177.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -69.5 -39.8 77.4 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.854 -177.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.61 -34.23 77.76 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -178.766 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 . . . . . 0 N--CA 1.446 -0.627 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.904 -178.902 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.49 HD21 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.207 -1.151 0 N-CA-C 110.603 -0.147 . . . . 0.0 110.603 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.3 tp -65.37 -36.93 85.48 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 176.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 62.4 m -64.36 -46.39 83.6 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 14.7 m -67.03 -34.69 78.25 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.974 178.392 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.8 t70 . . . . . 0 C--N 1.319 -0.74 0 C-N-CA 123.901 0.881 . . . . 0.0 108.85 179.268 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 17.8 ptm . . . . . 0 C--O 1.181 -2.544 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.483 ' CD ' ' H ' ' B' ' 142' ' ' GLU . 1.8 mp0 -26.92 -61.1 0.09 Allowed 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -167.805 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 28.5 m -71.27 -38.19 71.88 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.834 -0.541 . . . . 0.0 111.671 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 48.0 mm -68.68 -47.56 75.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.504 ' HA ' ' OH ' ' A' ' 65' ' ' TYR . 7.9 tp -61.75 -39.07 82.01 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.307 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 41.3 ttt180 -65.35 -49.5 69.11 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 118.573 -1.251 . . . . 0.0 110.82 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 28.9 m -66.08 -44.84 83.28 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.0 -40.28 39.57 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 121.076 -0.249 . . . . 0.0 111.586 -175.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.642 HD11 HD13 ' A' ' 72' ' ' ILE . 2.8 tm? . . . . . 0 C--N 1.313 -0.987 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.358 -173.034 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.615 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.2 ptpt . . . . . 0 N--CA 1.421 -1.883 0 CA-C-O 121.821 0.819 . . . . 0.0 110.175 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.02 -8.4 8.33 Favored Glycine 0 C--O 1.243 0.669 0 CA-C-N 114.29 -1.323 . . . . 0.0 115.471 -173.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.615 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 59.7 p-90 -62.48 -16.25 54.4 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 117.129 0.465 . . . . 0.0 111.405 177.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -59.97 -11.84 6.6 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 178.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -89.82 -8.31 52.35 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.034 0.445 . . . . 0.0 110.336 178.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -107.6 13.61 26.51 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.628 0.728 . . . . 0.0 111.042 -174.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.3 p -134.14 110.52 13.86 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.205 0 CA-C-O 122.156 0.979 . . . . 0.0 108.598 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.9 m -81.16 154.35 26.76 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.197 -173.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.425 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 1.5 tm0? -59.49 -34.84 73.08 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.415 178.458 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.98 -39.21 81.05 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.941 176.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.536 ' O ' HD13 ' A' ' 18' ' ' LEU . 2.9 tm? -69.67 -52.43 25.82 Favored 'General case' 0 CA--C 1.493 -1.247 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 -177.256 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.568 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.2 ptm180 -65.1 -44.17 89.7 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.882 -175.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.0 t -66.52 -27.13 67.52 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 24.9 t60 -67.62 -46.31 72.87 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.705 HD23 HD21 ' A' ' 68' ' ' LEU . 5.1 mp -63.89 -38.99 93.13 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.698 177.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.6 t -58.19 -48.38 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 123.644 0.778 . . . . 0.0 109.972 174.403 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.537 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 18.5 t-80 -55.37 -45.85 76.5 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.445 0.698 . . . . 0.0 110.351 177.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.581 ' HD3' HD22 ' B' ' 149' ' ' LEU . 34.1 mttp -65.67 -38.65 89.87 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.87 178.237 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.99 -44.65 82.91 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.537 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 25.1 t -53.73 -49.36 57.91 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.906 0 C-N-CA 124.055 0.942 . . . . 0.0 110.931 172.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -69.61 -25.86 64.16 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.029 -0.668 . . . . 0.0 112.58 -176.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.421 ' O ' HD11 ' B' ' 114' ' ' LEU . . . -78.83 -42.18 28.3 Favored 'General case' 0 C--O 1.196 -1.732 0 C-N-CA 120.971 -0.292 . . . . 0.0 110.747 174.038 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.496 ' HA ' HD21 ' B' ' 114' ' ' LEU . 3.9 tt -70.68 -38.82 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 119.902 -0.719 . . . . 0.0 111.194 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.421 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 84.4 t80 -125.52 99.09 33.61 Favored Pre-proline 0 N--CA 1.415 -2.192 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -175.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 19.5 Cg_endo -60.43 97.84 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 121.735 1.623 . . . . 0.0 108.815 170.186 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.0 t -75.8 136.68 70.24 Favored Pre-proline 0 N--CA 1.426 -1.664 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.624 -176.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.48 -21.3 11.68 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 122.498 2.132 . . . . 0.0 111.677 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -158.31 141.93 11.11 Favored Pre-proline 0 CA--C 1.496 -1.133 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -176.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -55.49 -20.04 25.16 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.913 2.409 . . . . 0.0 114.61 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.9 -10.04 59.41 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 121.171 -0.956 . . . . 0.0 112.03 179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -6.56 55.24 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.179 0.99 . . . . 0.0 108.828 174.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.506 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.4 mt -90.94 5.65 47.85 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.22 -179.255 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.13 26.96 4.21 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 176.1 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.57 ' O ' ' HB3' ' A' ' 40' ' ' MET . 22.7 t70 -92.29 173.08 8.0 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.627 -1.169 . . . . 0.0 109.424 -177.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.544 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.26 -25.94 62.68 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.209 0.528 . . . . 0.0 110.324 177.811 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.489 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 33.7 ttm180 -72.19 -27.43 62.55 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-O 121.589 0.709 . . . . 0.0 109.951 176.043 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.639 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 4.8 tpp -57.25 -37.41 72.26 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.242 178.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -61.44 -29.08 69.72 Favored 'General case' 0 C--O 1.202 -1.407 0 C-N-CA 119.023 -1.071 . . . . 0.0 110.245 -179.219 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.489 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.3 t30 -69.68 -48.63 59.03 Favored 'General case' 0 C--O 1.253 1.25 0 C-N-CA 122.849 0.46 . . . . 0.0 109.993 175.192 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.446 HD22 ' O ' ' A' ' 39' ' ' ARG . 2.7 mm? -61.97 -51.61 67.37 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.274 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.639 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -67.77 -29.21 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.832 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.082 -176.527 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.96 92.27 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.097 0.475 . . . . 0.0 109.865 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.57 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 1.7 t80 -62.38 -46.86 86.72 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.622 174.629 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.81 91.54 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.092 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -64.75 -44.28 90.59 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 123.742 0.817 . . . . 0.0 112.487 177.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.7 pttp -64.77 -39.94 94.44 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-O 121.489 0.661 . . . . 0.0 109.532 -178.63 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.1 t -67.68 -53.24 32.84 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.978 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -55.4 -48.33 74.52 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 124.036 0.934 . . . . 0.0 110.02 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.37 -37.79 94.65 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.486 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -64.52 -47.76 77.64 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 121.398 0.618 . . . . 0.0 110.718 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.471 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -70.28 -29.49 66.27 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 121.817 -0.552 . . . . 0.0 112.11 176.688 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -62.9 -54.7 34.54 Favored 'General case' 0 C--O 1.193 -1.873 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -68.99 -27.2 65.48 Favored 'General case' 0 C--N 1.307 -1.252 0 O-C-N 122.027 -0.421 . . . . 0.0 111.563 -177.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.2 t -74.34 -32.97 62.99 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 123.504 0.721 . . . . 0.0 112.455 -178.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.03 159.92 30.33 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -174.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -98.93 -1.98 38.65 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.171 178.325 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.434 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 66.4 p -168.17 158.0 9.84 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.529 174.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.486 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -62.56 -35.62 80.05 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -179.318 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -67.57 -33.67 75.5 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -70.75 -44.76 66.09 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.683 175.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -45.8 89.14 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.481 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 1.3 t80 -60.74 -46.59 89.83 Favored 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.031 176.36 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -59.18 -52.04 67.42 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.471 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -67.88 -37.63 82.02 Favored 'General case' 0 C--O 1.267 2.016 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.944 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.705 HD21 HD23 ' A' ' 18' ' ' LEU . 1.5 pp -68.9 -36.62 78.26 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.529 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.02 -41.21 97.52 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.607 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -62.77 -46.42 88.11 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.542 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -38.07 69.94 Favored 'General case' 0 N--CA 1.438 -1.047 0 C-N-CA 118.935 -1.106 . . . . 0.0 112.14 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.541 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 4.2 tt -65.26 -45.83 92.46 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.15 178.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.489 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 17.8 t80 -53.29 -53.34 52.37 Favored 'General case' 0 C--O 1.272 2.259 0 C-N-CA 125.37 1.468 . . . . 0.0 111.409 178.831 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.3 ptpt -63.72 -34.22 77.39 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.756 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.78 -40.78 84.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 O-C-N 123.5 0.5 . . . . 0.0 111.913 177.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.601 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.4 mm-40 -57.96 -53.59 56.57 Favored 'General case' 0 C--O 1.253 1.239 0 CA-C-O 121.967 0.889 . . . . 0.0 109.554 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.545 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 12.2 ptpt -70.3 -32.53 70.35 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 118.977 -1.089 . . . . 0.0 112.888 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.491 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 18.6 tp10 -62.34 -46.35 89.07 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.469 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.2 pp -63.45 -43.27 97.86 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.042 -177.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.495 ' N ' HD12 ' A' ' 79' ' ' LEU . 7.2 pt-20 -69.38 -43.82 72.74 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 118.809 -1.156 . . . . 0.0 112.156 -178.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 13.3 pt-20 -69.98 -32.27 70.4 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 120.325 -0.55 . . . . 0.0 112.066 -178.008 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.494 ' HD2' ' C ' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -72.93 -35.5 67.02 Favored 'General case' 0 C--O 1.215 -0.761 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.221 177.647 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.416 ' HD3' ' OD2' ' B' ' 118' ' ' ASP . 18.5 tpt180 . . . . . 0 C--O 1.234 0.276 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.149 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.191 -2.007 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 58.9 tp -62.37 -33.35 74.57 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 121.211 0.529 . . . . 0.0 110.135 175.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 40.9 m -72.15 -43.69 64.25 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.477 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 13.5 p -73.52 -26.89 61.08 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-O 121.442 0.639 . . . . 0.0 110.909 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.416 ' OD2' ' HD3' ' A' ' 83' ' ' ARG . 5.4 t70 . . . . . 0 C--N 1.312 -1.06 0 C-N-CA 124.456 1.102 . . . . 0.0 109.695 173.095 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 21.5 ptp . . . . . 0 N--CA 1.484 1.248 0 N-CA-C 117.027 2.232 . . . . 0.0 117.027 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -21.92 -64.77 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 118.717 2.858 . . . . 0.0 118.717 -165.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 19.4 p -67.65 -44.69 77.3 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.172 0.511 . . . . 0.0 111.721 -171.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 57.2 mt -66.55 -46.6 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.946 -178.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 145' ' ' ILE . . . . . 0.485 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 18.2 tt -67.65 -33.36 61.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -69.64 -52.45 25.77 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.642 176.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.3 m -64.85 -41.81 95.39 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -176.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -81.08 -39.89 24.99 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -177.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.581 HD22 ' HD3' ' A' ' 21' ' ' LYS . 8.3 tt . . . . . 0 C--N 1.315 -0.927 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 -169.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.458 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 79.3 mttt . . . . . 0 N--CA 1.428 -1.557 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.31 -20.55 10.43 Favored Glycine 0 N--CA 1.466 0.648 0 N-CA-C 115.69 1.036 . . . . 0.0 115.69 -174.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.458 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 67.2 p-90 -70.39 -12.57 61.67 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 122.287 -0.537 . . . . 0.0 111.986 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -58.96 -21.2 58.05 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-O 120.92 0.391 . . . . 0.0 111.955 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -82.38 -13.48 56.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.477 0.656 . . . . 0.0 110.316 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -94.24 2.26 55.91 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.218 -176.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.457 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.9 p -129.12 110.86 21.44 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 CA-C-O 121.416 0.627 . . . . 0.0 110.07 -177.473 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 m -88.72 157.19 18.6 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.928 -176.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.4 tm0? -53.59 -37.32 62.85 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.841 0.856 . . . . 0.0 111.267 178.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.07 -35.36 80.01 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.569 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -70.49 -52.0 25.03 Favored 'General case' 0 CA--C 1.488 -1.438 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -176.112 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.509 ' O ' HG23 ' A' ' 19' ' ' VAL . 3.7 ptm180 -63.32 -44.62 94.43 Favored 'General case' 0 N--CA 1.42 -1.96 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.996 -178.276 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 t -61.95 -31.49 71.84 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.785 0.326 . . . . 0.0 110.445 178.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -66.66 -45.47 78.84 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.822 HD23 HD21 ' A' ' 68' ' ' LEU . 7.0 mp -67.32 -40.84 86.01 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.221 178.365 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 15' ' ' ARG . 54.6 t -56.47 -49.96 74.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 124.306 1.043 . . . . 0.0 109.828 175.012 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -58.12 -44.12 87.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.095 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -66.6 -40.92 89.1 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.931 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.524 ' O ' HG22 ' A' ' 26' ' ' ILE . 11.7 mt -50.83 -51.12 54.19 Favored 'General case' 0 CA--C 1.5 -0.959 0 O-C-N 124.211 0.944 . . . . 0.0 109.057 173.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.466 HG11 ' CE ' ' A' ' 40' ' ' MET . 79.2 t -55.23 -52.89 40.66 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.799 0 O-C-N 124.484 1.115 . . . . 0.0 111.05 175.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -52.46 -35.83 53.38 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.89 -46.48 14.03 Favored 'General case' 0 C--O 1.2 -1.518 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 176.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.625 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.5 -24.76 14.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-O 122.218 1.009 . . . . 0.0 110.499 -174.111 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.625 ' CD2' HG23 ' A' ' 26' ' ' ILE . 75.1 m-85 -131.01 86.52 51.53 Favored Pre-proline 0 C--N 1.271 -2.828 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.497 178.384 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -61.22 104.88 0.31 Allowed 'Trans proline' 0 N--CA 1.441 -1.57 0 N-CA-C 108.636 -1.332 . . . . 0.0 108.636 175.268 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.9 t -72.68 143.03 84.29 Favored Pre-proline 0 N--CA 1.422 -1.865 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.751 -173.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -77.94 -29.51 4.25 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.226 2.618 . . . . 0.0 111.073 175.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -137.72 135.92 19.54 Favored Pre-proline 0 CA--C 1.493 -1.215 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -176.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -63.8 -18.42 63.92 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 121.472 1.448 . . . . 0.0 111.587 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.7 -15.25 55.04 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 121.748 -0.595 . . . . 0.0 111.189 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.76 -16.21 63.27 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 121.468 0.652 . . . . 0.0 109.353 175.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.5 mt -81.02 3.4 23.21 Favored 'General case' 0 C--O 1.214 -0.809 0 CA-C-N 114.496 -1.229 . . . . 0.0 110.547 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.81 10.85 2.89 Favored 'General case' 0 C--N 1.288 -2.095 0 O-C-N 121.366 -0.834 . . . . 0.0 110.099 170.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 40' ' ' MET . 1.9 t70 -104.72 -167.3 1.33 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.202 -170.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -61.92 -36.39 81.23 Favored 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 118.264 0.484 . . . . 0.0 111.632 -177.093 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.554 ' O ' HD13 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -64.55 -33.82 76.8 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -177.864 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.569 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.77 -33.45 71.7 Favored 'General case' 0 C--O 1.171 -3.074 0 CA-C-O 118.435 -0.793 . . . . 0.0 111.1 -178.899 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 8.1 pt-20 -64.05 -34.18 77.43 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.235 0.925 . . . . 0.0 110.477 -176.154 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -71.81 -45.62 60.92 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.819 0.818 . . . . 0.0 109.379 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.562 HD22 ' HA ' ' A' ' 40' ' ' MET . 0.3 OUTLIER -57.01 -52.61 64.59 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 113.946 -1.479 . . . . 0.0 110.808 -179.147 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 40' ' ' MET . 27.6 m -69.97 -32.02 50.0 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.487 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.347 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.64 -48.86 74.28 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 175.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.584 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 9.7 t80 -63.92 -48.66 75.69 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.943 174.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.419 ' CB ' HG13 ' A' ' 19' ' ' VAL . . . -61.03 -40.66 94.43 Favored 'General case' 0 C--O 1.196 -1.752 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.498 -176.03 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 mttm -66.09 -42.28 89.54 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 123.676 0.79 . . . . 0.0 111.533 178.224 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.0 pttp -65.47 -40.65 93.4 Favored 'General case' 0 C--O 1.254 1.309 0 CA-C-O 121.443 0.639 . . . . 0.0 110.19 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.424 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 78.3 t -71.56 -47.5 57.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.519 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -57.93 -47.68 82.15 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 123.53 0.732 . . . . 0.0 109.269 179.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.31 -39.46 92.65 Favored Glycine 0 CA--C 1.505 -0.551 0 O-C-N 123.673 0.608 . . . . 0.0 112.104 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.0 -54.26 48.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.034 0.445 . . . . 0.0 110.804 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.518 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -67.89 -29.3 68.37 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 179.019 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -61.63 -54.39 43.54 Favored 'General case' 0 C--O 1.2 -1.526 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 176.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -74.02 -22.12 59.7 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.826 -0.546 . . . . 0.0 111.815 -176.125 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -79.96 -21.5 43.7 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-O 120.715 0.293 . . . . 0.0 111.01 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.05 165.14 17.76 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -176.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -107.08 -0.74 22.68 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.306 177.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.9 p -162.86 159.08 23.42 Favored 'General case' 0 CA--C 1.482 -1.648 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.457 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.28 -24.73 61.39 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 119.016 -1.074 . . . . 0.0 110.344 178.531 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -63.62 -47.31 81.9 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -63.23 -47.98 80.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.785 176.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.414 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -61.85 -45.7 92.66 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 123.156 0.285 . . . . 0.0 110.753 -176.977 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -62.2 -47.01 86.34 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.961 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.547 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 14.6 t60 -57.78 -54.59 45.12 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.408 0.443 . . . . 0.0 111.195 -178.396 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.518 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.5 pp -67.71 -32.11 72.52 Favored 'General case' 0 C--O 1.245 0.833 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -175.737 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.822 HD21 HD23 ' A' ' 18' ' ' LEU . 1.2 pp -75.65 -31.0 59.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.774 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.554 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -67.23 -34.22 77.0 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.948 176.493 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 10.6 mm-40 -66.8 -44.34 81.48 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.631 0.729 . . . . 0.0 109.318 176.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -42.59 86.45 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.096 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.554 HG22 ' HA ' ' A' ' 69' ' ' ALA . 6.0 tt -65.12 -46.61 90.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 C-N-CA 119.999 -0.681 . . . . 0.0 110.67 -178.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.698 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 59.4 t80 -50.65 -54.23 24.59 Favored 'General case' 0 C--O 1.268 2.043 0 C-N-CA 125.808 1.643 . . . . 0.0 110.764 177.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -63.74 -31.66 72.9 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.705 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.76 -37.57 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.475 177.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.552 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 8.2 mt-30 -68.04 -42.04 81.16 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.832 -177.229 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.698 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.4 OUTLIER -70.24 -30.4 67.46 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 119.199 -1.001 . . . . 0.0 112.205 176.27 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.82 -45.42 89.7 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 176.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.601 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -65.95 -41.2 91.59 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.536 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 16.0 pt-20 -69.86 -41.61 74.62 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.593 -177.215 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 8.4 pt-20 -65.79 -44.41 85.83 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.308 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.415 ' HE2' ' HB2' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -65.18 -42.37 93.72 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.158 -175.952 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.415 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 54.4 ttp180 . . . . . 0 C--O 1.243 0.755 0 C-N-CA 120.93 -0.308 . . . . 0.0 110.89 -178.064 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 114' ' ' LEU . . . . . 0.601 HD21 ' HB3' ' A' ' 79' ' ' LEU . 40.6 tp . . . . . 0 C--O 1.188 -2.175 0 N-CA-C 111.4 0.148 . . . . 0.0 111.4 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.4 tp -69.9 -45.41 67.69 Favored 'General case' 0 C--O 1.246 0.907 0 O-C-N 121.88 -0.513 . . . . 0.0 110.412 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 35.7 m -61.56 -33.2 73.44 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.01 177.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 117' ' ' SER . . . . . 0.502 ' HB3' ' CD1' ' A' ' 27' ' ' PHE . 19.8 m -77.67 -43.49 31.07 Favored 'General case' 0 CA--C 1.56 1.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.808 176.348 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 6.7 t70 . . . . . 0 N--CA 1.487 1.422 0 C-N-CA 124.799 1.24 . . . . 0.0 111.339 -175.06 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 58.0 mtm . . . . . 0 C--O 1.188 -2.152 0 CA-C-O 118.541 -0.743 . . . . 0.0 112.834 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -25.07 -60.25 0.06 Allowed 'General case' 0 N--CA 1.51 2.559 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 -168.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 5.2 p -61.27 -43.57 98.66 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 122.238 1.018 . . . . 0.0 111.128 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 45.9 mm -70.2 -38.33 74.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.837 0 CA-C-N 114.005 -1.452 . . . . 0.0 109.73 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 18.3 mm -54.7 -49.65 66.41 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.923 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.553 175.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -58.69 -65.11 0.71 Allowed 'General case' 0 N--CA 1.43 -1.442 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.308 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 65.3 m -61.97 -54.79 36.87 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -174.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -81.47 -35.59 30.34 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -174.071 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 9.1 tt . . . . . 0 N--CA 1.438 -1.056 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -170.895 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.525 0 N-CA-C 109.764 -1.335 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 73.3 t 67.19 133.89 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 121.671 0.748 . . . . 0.0 111.812 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.92 108.28 11.06 Favored 'General case' 0 CA--C 1.467 -2.238 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.642 177.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 10.0 ptpp? -130.9 95.91 3.94 Favored 'General case' 0 N--CA 1.39 -3.466 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.553 177.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.25 -9.74 24.54 Favored Glycine 0 C--O 1.238 0.376 0 CA-C-N 114.391 -1.277 . . . . 0.0 115.158 -174.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.48 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 66.0 p-90 -68.55 -9.13 47.43 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 117.196 0.498 . . . . 0.0 112.067 178.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -58.54 -24.09 59.84 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-O 120.918 0.389 . . . . 0.0 111.797 177.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.18 -10.6 59.71 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.171 0.51 . . . . 0.0 110.406 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -105.47 10.88 33.1 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.398 0.618 . . . . 0.0 110.53 -176.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.49 HG23 HD12 ' A' ' 14' ' ' LEU . 7.5 p -139.86 128.57 27.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 p -106.66 162.09 14.06 Favored 'General case' 0 CA--C 1.473 -1.986 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.482 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 11.6 tt0 -53.63 -41.58 66.86 Favored 'General case' 0 N--CA 1.422 -1.845 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.596 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.572 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 6.2 t70 -58.69 -40.85 84.82 Favored 'General case' 0 C--O 1.203 -1.394 0 O-C-N 122.951 0.157 . . . . 0.0 111.225 178.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.49 HD12 HG23 ' A' ' 10' ' ' VAL . 3.1 tm? -69.3 -50.15 49.4 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -175.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.491 ' O ' HG23 ' A' ' 19' ' ' VAL . 13.4 ptm180 -63.79 -46.15 86.5 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.623 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.7 t -67.48 -26.66 66.48 Favored 'General case' 0 CA--C 1.556 1.186 0 CA-C-O 121.033 0.444 . . . . 0.0 110.37 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.572 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 12.3 t60 -68.1 -49.41 61.33 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.627 HD23 HD21 ' A' ' 68' ' ' LEU . 1.2 mp -60.25 -49.55 77.15 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.524 176.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.535 HG13 ' CB ' ' A' ' 47' ' ' ALA . 21.4 t -52.13 -43.3 37.82 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.765 0 C-N-CA 124.581 1.153 . . . . 0.0 109.034 177.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -58.51 -44.93 89.65 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 122.751 0.42 . . . . 0.0 110.396 177.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.557 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 2.5 mptp? -65.03 -35.57 81.58 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.576 175.271 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.453 HD21 ' HZ1' ' A' ' 71' ' ' LYS . 9.0 mp -55.5 -44.72 76.84 Favored 'General case' 0 CA--C 1.476 -1.897 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.816 176.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.63 HG11 ' HE1' ' A' ' 40' ' ' MET . 78.6 t -58.77 -47.15 90.06 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.919 0 O-C-N 124.134 0.896 . . . . 0.0 110.688 174.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -56.86 -33.76 67.14 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.986 0.422 . . . . 0.0 111.869 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.87 -45.7 15.14 Favored 'General case' 0 C--O 1.192 -1.943 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 177.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.54 HG22 ' HA ' ' A' ' 23' ' ' VAL . 3.2 tt -71.55 -35.27 55.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 O-C-N 121.105 -0.997 . . . . 0.0 110.218 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -119.2 96.88 50.32 Favored Pre-proline 0 N--CA 1.398 -3.036 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 -179.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.97 96.68 0.1 Allowed 'Trans proline' 0 C--O 1.256 1.408 0 C-N-CA 121.616 1.544 . . . . 0.0 108.444 171.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.7 t -75.81 134.8 71.64 Favored Pre-proline 0 N--CA 1.411 -2.413 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.144 -172.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -73.68 -20.97 19.6 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 122.619 2.213 . . . . 0.0 111.487 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -159.31 144.14 11.45 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 -177.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -57.52 -19.74 38.04 Favored 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 122.512 2.141 . . . . 0.0 114.091 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.43 -11.69 59.91 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 121.122 -0.986 . . . . 0.0 112.162 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.83 -8.1 56.7 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.076 0.941 . . . . 0.0 109.269 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 30.7 mt -90.12 2.1 55.67 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.864 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 36' ' ' LYS . 15.1 ptpt -133.8 23.94 3.96 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 122.448 1.118 . . . . 0.0 108.144 178.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.676 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 25.4 t70 -98.18 176.43 5.74 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 113.778 -1.556 . . . . 0.0 110.269 -175.145 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.676 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.55 -23.2 61.72 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 123.387 0.675 . . . . 0.0 111.132 178.5 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.528 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 41.9 ttm180 -72.94 -26.38 61.36 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 176.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.797 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.5 tpp -61.07 -38.62 86.87 Favored 'General case' 0 C--O 1.193 -1.87 0 CA-C-N 114.518 -1.219 . . . . 0.0 112.636 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 7.2 pt-20 -59.24 -32.07 69.65 Favored 'General case' 0 C--O 1.204 -1.295 0 C-N-CA 118.886 -1.126 . . . . 0.0 110.757 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -75.46 -46.29 33.44 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 123.839 0.855 . . . . 0.0 110.29 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 68.4 mt -63.82 -47.07 82.3 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.793 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.797 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.5 p -72.16 -28.55 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.938 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.58 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -57.06 -47.35 81.19 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 176.461 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.536 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 1.6 t80 -61.28 -47.99 83.44 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.833 174.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.535 ' CB ' HG13 ' A' ' 19' ' ' VAL . . . -59.52 -44.2 93.22 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.757 -176.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -62.38 -42.47 99.44 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.433 0.693 . . . . 0.0 111.314 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 55.8 pttt -69.27 -39.72 78.22 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.297 0.57 . . . . 0.0 110.635 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 49.4 t -69.5 -47.8 70.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.002 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' OE2' HD22 ' A' ' 68' ' ' LEU . 12.6 mm-40 -60.73 -37.54 82.09 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.559 178.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.87 -39.19 97.19 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.54 -0.755 . . . . 0.0 112.082 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.24 -52.84 63.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.807 0.337 . . . . 0.0 110.515 177.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.472 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -68.87 -30.15 68.6 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 179.332 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.44 -47.32 86.63 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 175.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.62 -19.15 55.98 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.298 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.0 t -79.22 -27.83 42.49 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.208 0.528 . . . . 0.0 110.176 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.76 165.29 13.01 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-O 121.627 0.727 . . . . 0.0 112.692 -175.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -116.95 18.41 14.71 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.436 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.8 p -168.45 158.54 9.72 Favored 'General case' 0 CA--C 1.49 -1.34 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 173.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HA ' ' HD1' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -71.85 -30.7 65.72 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.969 177.919 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -58.78 -47.49 84.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.111 -0.949 . . . . 0.0 108.911 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -65.86 -46.41 78.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.392 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.435 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -63.33 -45.07 92.98 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -176.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.434 ' HA ' ' CD2' ' A' ' 68' ' ' LEU . 7.6 t80 -63.55 -39.7 95.09 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.601 178.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -62.7 -55.86 22.94 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.472 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.4 pp -65.35 -33.14 75.27 Favored 'General case' 0 C--O 1.255 1.39 0 CA-C-O 121.598 0.713 . . . . 0.0 111.482 -175.196 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.627 HD21 HD23 ' A' ' 18' ' ' LEU . 1.4 pp -73.42 -32.41 64.4 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.909 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.527 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -68.44 -33.97 75.14 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.674 178.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -66.1 -43.16 88.05 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.403 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.508 ' NZ ' ' HB2' ' A' ' 68' ' ' LEU . 1.4 pptp? -65.17 -42.67 93.44 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 119.811 -0.756 . . . . 0.0 111.925 179.022 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.605 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.1 tt -65.94 -40.42 87.37 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.693 0 CA-C-O 121.006 0.432 . . . . 0.0 110.163 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.517 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 62.6 t80 -57.33 -52.86 63.64 Favored 'General case' 0 C--O 1.272 2.261 0 C-N-CA 124.963 1.305 . . . . 0.0 110.495 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -64.38 -33.07 75.0 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.225 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.72 -38.31 81.98 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.992 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.609 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 53.0 mt-30 -69.62 -43.86 71.84 Favored 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.626 -175.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.517 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.2 OUTLIER -70.44 -28.24 64.87 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 118.648 -1.221 . . . . 0.0 112.782 175.98 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -61.74 -49.41 76.51 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 175.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.4 pp -64.84 -40.45 95.2 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.76 -176.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.432 ' N ' HD12 ' A' ' 79' ' ' LEU . 45.9 mt-10 -62.68 -50.42 71.22 Favored 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 123.665 0.603 . . . . 0.0 112.211 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.5 pt-20 -72.57 -32.09 65.75 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 119.708 -0.797 . . . . 0.0 112.787 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.54 -35.23 80.23 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -77.61 -39.18 46.26 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.027 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.429 ' O ' ' HB2' ' A' ' 85' ' ' SER . 7.8 tmm_? -70.79 -58.68 3.38 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 118.605 -0.712 . . . . 0.0 111.523 -177.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 30.3 t 167.8 104.25 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.418 0.687 . . . . 0.0 111.429 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.435 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 1.6 ptp180 -132.93 -31.8 1.27 Allowed 'General case' 0 C--N 1.316 -0.868 0 O-C-N 121.505 -0.747 . . . . 0.0 109.846 169.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.434 ' HG ' ' HG3' ' A' ' 86' ' ' ARG . 69.3 mt . . . . . 0 C--O 1.249 1.049 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.519 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 26.3 t -154.93 140.23 17.65 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 106.725 -1.584 . . . . 0.0 106.725 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.445 ' O ' ' HG3' ' B' ' 112' ' ' GLN . 22.9 ptp -74.41 -21.22 59.74 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.541 -178.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 32.8 t -90.37 -84.93 0.23 Allowed 'General case' 0 N--CA 1.421 -1.889 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 63.2 t-80 65.3 -42.09 0.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 126.055 1.742 . . . . 0.0 114.418 175.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' TYR . . . . . 0.48 ' HA ' ' OE1' ' B' ' 109' ' ' GLN . 80.1 t80 84.19 127.5 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 126.699 2.0 . . . . 0.0 109.118 -169.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 90.65 -21.01 35.03 Favored Glycine 0 C--O 1.214 -1.096 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -89.35 1.2 56.12 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 124.317 1.047 . . . . 0.0 109.754 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.48 ' OE1' ' HA ' ' B' ' 106' ' ' TYR . 1.9 mp0 -60.67 -33.65 73.14 Favored 'General case' 0 CA--C 1.498 -1.024 0 CA-C-N 115.047 -0.978 . . . . 0.0 109.985 178.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 110' ' ' THR . . . . . 0.584 ' O ' ' HB2' ' B' ' 114' ' ' LEU . 19.6 p -58.17 -52.74 64.28 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.36 -179.156 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 64.1 tp -61.56 -50.57 72.1 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.806 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' B' ' 103' ' ' MET . 86.6 mm-40 -64.67 -52.58 56.5 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -175.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -68.71 -36.8 78.91 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.392 -173.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.584 ' HB2' ' O ' ' B' ' 110' ' ' THR . 0.2 OUTLIER -73.66 -31.92 63.73 Favored 'General case' 0 C--O 1.212 -0.9 0 C-N-CA 120.48 -0.488 . . . . 0.0 111.315 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' B' ' 118' ' ' ASP . 51.6 tp -67.4 -41.85 84.25 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 175.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.8 m -65.71 -39.46 91.22 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.27 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.502 ' HA ' ' HB2' ' B' ' 120' ' ' LEU . 22.5 m -77.37 -20.65 54.45 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.386 0.613 . . . . 0.0 111.375 178.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' B' ' 115' ' ' LEU . 9.8 t70 -66.56 -48.96 67.97 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 22.8 m -72.72 -9.46 58.66 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.271 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.506 ' O ' HD23 ' B' ' 120' ' ' LEU . 4.6 tt -72.02 -8.92 57.32 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 20.9 t -60.24 -45.28 93.8 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -90.42 73.45 6.96 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 173.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 49.7 m -153.82 167.38 29.87 Favored 'General case' 0 C--O 1.256 1.421 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -90.1 -80.67 0.31 Allowed 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -173.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 121.3 -140.49 14.02 Favored Glycine 0 N--CA 1.44 -1.097 0 C-N-CA 120.555 -0.831 . . . . 0.0 111.27 -177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -123.2 -108.0 1.87 Allowed Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.999 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -152.54 -29.83 0.04 OUTLIER Glycine 0 C--N 1.31 -0.887 0 C-N-CA 121.397 -0.43 . . . . 0.0 112.777 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.8 m -84.28 176.71 8.55 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.872 0.367 . . . . 0.0 111.225 -176.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -127.04 -108.68 1.55 Allowed Glycine 0 N--CA 1.439 -1.155 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -149.0 175.18 28.36 Favored Glycine 0 C--O 1.252 1.243 0 C-N-CA 121.001 -0.619 . . . . 0.0 111.958 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -157.48 154.42 25.52 Favored Glycine 0 N--CA 1.439 -1.138 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.2 t -147.78 -165.23 2.2 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 109.047 -0.724 . . . . 0.0 109.047 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 136.91 126.86 2.57 Favored Glycine 0 C--O 1.245 0.804 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -177.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 134' ' ' GLY . . . . . 0.421 ' N ' ' HB2' ' A' ' 13' ' ' ASP . . . 145.46 -131.97 4.42 Favored Glycine 0 C--N 1.31 -0.874 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -179.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 135' ' ' GLY . . . . . 0.415 ' HA2' ' OE1' ' B' ' 138' ' ' GLU . . . 132.89 109.51 1.16 Allowed Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.473 -0.87 . . . . 0.0 111.712 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.2 m -147.88 -61.12 0.26 Allowed 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.16 0.505 . . . . 0.0 111.075 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.676 ' O ' ' HB2' ' B' ' 141' ' ' MET . 86.2 mt -101.0 -45.12 5.51 Favored 'General case' 0 C--O 1.216 -0.71 0 O-C-N 122.149 -0.344 . . . . 0.0 111.156 -173.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.476 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 0.0 OUTLIER -50.98 -42.89 60.44 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 124.866 1.266 . . . . 0.0 112.865 -177.213 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 39.0 m -39.38 -58.12 1.28 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.48 1.512 . . . . 0.0 114.154 -174.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -121.25 32.02 6.1 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 123.038 1.399 . . . . 0.0 110.17 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.676 ' HB2' ' O ' ' B' ' 137' ' ' LEU . 26.3 ttp -93.33 -9.37 39.08 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.038 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -14.82 -71.98 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 127.22 2.208 . . . . 0.0 116.711 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 20.2 m -70.5 -38.8 74.36 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 122.01 -0.432 . . . . 0.0 111.623 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 66.8 mt -66.88 -45.95 86.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.406 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 14.7 tt -66.04 -37.21 79.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.349 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -61.29 -52.84 63.02 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.6 t -68.63 -54.06 18.74 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -176.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -80.96 -37.4 29.46 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -173.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.527 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 52.7 tp -84.84 -24.82 28.44 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.205 0.457 . . . . 0.0 109.932 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 28.3 ttt 82.9 89.76 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 173.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -107.93 88.93 2.85 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.575 0 O-C-N 123.848 0.717 . . . . 0.0 111.566 -173.74 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.517 0 N-CA-C 110.471 -1.051 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 15.3 m -81.65 114.11 22.06 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.18 108.44 18.91 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 122.542 1.163 . . . . 0.0 111.432 -171.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.513 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 39.1 mttp -95.41 118.62 32.47 Favored 'General case' 0 C--N 1.273 -2.718 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.061 -172.014 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -67.22 -17.42 68.13 Favored Glycine 0 C--N 1.317 -0.495 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.497 -176.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.513 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 63.1 p-90 -68.19 -10.25 52.96 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.48 -17.61 59.96 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -81.67 -9.46 59.65 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 121.162 0.506 . . . . 0.0 109.989 177.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.434 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 53.5 m-70 -101.63 9.66 40.9 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.91 -178.083 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.6 p -140.05 110.86 4.19 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.732 0 CA-C-O 122.24 1.019 . . . . 0.0 109.429 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 m -88.38 161.29 17.17 Favored 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.095 -0.957 . . . . 0.0 108.705 -176.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -54.56 -36.9 64.83 Favored 'General case' 0 C--O 1.195 -1.81 0 C-N-CA 122.891 0.477 . . . . 0.0 110.17 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -52.09 -46.43 65.22 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 123.919 0.888 . . . . 0.0 113.134 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.505 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -70.19 -50.64 38.08 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -174.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.543 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.1 ptm180 -64.17 -44.65 91.42 Favored 'General case' 0 N--CA 1.421 -1.891 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.12 -177.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.0 t -63.66 -30.48 71.58 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 122.966 0.507 . . . . 0.0 110.546 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -65.31 -47.22 77.35 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.817 HD23 HD21 ' A' ' 68' ' ' LEU . 5.4 mp -65.61 -40.92 93.15 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.476 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.2 t -58.84 -46.4 91.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 124.636 1.174 . . . . 0.0 110.166 176.092 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -57.32 -51.91 67.49 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.326 177.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.2 mttp -62.26 -40.33 95.83 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.692 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.523 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -51.84 -52.61 48.1 Favored 'General case' 0 CA--C 1.508 -0.667 0 C-N-CA 124.401 1.08 . . . . 0.0 108.922 176.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.467 HG13 ' HB3' ' A' ' 43' ' ' LEU . 39.4 t -54.1 -51.22 48.8 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.207 0 O-C-N 124.308 1.005 . . . . 0.0 110.752 176.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -56.92 -34.57 68.08 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -176.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.37 -46.76 14.19 Favored 'General case' 0 C--O 1.195 -1.795 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.74 177.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.616 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.84 -26.49 17.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 CA-C-O 122.063 0.935 . . . . 0.0 110.95 -174.073 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.616 ' CD2' HG23 ' A' ' 26' ' ' ILE . 69.4 m-85 -124.94 91.66 49.0 Favored Pre-proline 0 C--N 1.283 -2.305 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.129 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -65.68 102.02 0.49 Allowed 'Trans proline' 0 C--O 1.247 0.943 0 C-N-CA 122.134 1.89 . . . . 0.0 111.001 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.451 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 12.7 t -77.23 136.99 64.83 Favored Pre-proline 0 N--CA 1.423 -1.792 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.227 -176.326 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -76.5 -27.49 7.63 Favored 'Trans proline' 0 C--O 1.244 0.783 0 C-N-CA 122.974 2.449 . . . . 0.0 112.154 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -147.52 149.19 33.42 Favored Pre-proline 0 CA--C 1.485 -1.528 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.29 -9.91 26.85 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 121.626 1.551 . . . . 0.0 111.702 177.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.24 -10.44 57.69 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.15 0.5 . . . . 0.0 111.522 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.451 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -81.11 -6.56 58.97 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.936 0.874 . . . . 0.0 109.025 176.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.553 ' HA ' ' HE3' ' A' ' 40' ' ' MET . 21.8 mt -90.85 5.55 48.03 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.366 -178.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -133.48 17.71 3.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.107 0.956 . . . . 0.0 108.926 177.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.656 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 15.3 t70 -88.54 176.69 7.04 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.974 -176.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.656 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.8 OUTLIER -71.29 -26.72 62.99 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 173.915 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.584 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 32.2 ttm180 -59.4 -36.05 75.11 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.933 -1.03 . . . . 0.0 109.391 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.553 ' HE3' ' HA ' ' A' ' 35' ' ' LEU . 8.6 tpp -58.75 -37.89 77.22 Favored 'General case' 0 C--O 1.212 -0.905 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.869 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -66.76 -27.83 67.92 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 117.947 -1.501 . . . . 0.0 110.072 -178.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -75.03 -42.06 57.97 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.522 0.729 . . . . 0.0 110.208 176.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.589 HD22 ' CG ' ' A' ' 27' ' ' PHE . 28.3 mt -61.92 -53.57 53.95 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.878 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.416 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.0 p -70.22 -27.79 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.597 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.267 -178.154 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.67 84.96 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.938 0.399 . . . . 0.0 110.199 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.54 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -60.29 -44.7 95.16 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.889 175.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.3 -41.93 97.82 Favored 'General case' 0 C--O 1.199 -1.58 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.485 -177.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.5 mttm -64.65 -44.22 91.14 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 176.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 58.2 pttt -63.8 -40.55 96.92 Favored 'General case' 0 C--O 1.256 1.424 0 CA-C-O 121.544 0.688 . . . . 0.0 110.373 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.457 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 48.7 t -70.74 -45.32 74.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 114.933 -1.031 . . . . 0.0 110.694 178.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.408 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.9 tm-20 -56.98 -46.2 82.41 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.75 -37.05 92.95 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.624 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -61.04 -52.98 62.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.012 0.434 . . . . 0.0 110.592 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.554 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -69.85 -27.75 65.1 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 179.04 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -62.83 -49.5 74.67 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 175.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -74.5 -19.51 60.34 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.7 t -79.65 -20.08 47.58 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 120.717 0.294 . . . . 0.0 110.78 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.52 161.67 13.55 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -174.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -107.86 5.6 26.6 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.47 -1.241 . . . . 0.0 110.53 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 75.5 p -164.02 159.51 20.74 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.434 ' NE ' ' HB3' ' A' ' 9' ' ' HIS . 0.2 OUTLIER -72.51 -24.07 61.1 Favored 'General case' 0 C--O 1.197 -1.677 0 C-N-CA 118.91 -1.116 . . . . 0.0 109.818 177.746 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -66.02 -44.46 84.63 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -66.3 -46.34 77.29 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.282 175.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.409 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.1 -45.36 89.01 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 123.157 0.286 . . . . 0.0 110.54 -177.474 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -44.09 95.0 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 123.762 0.664 . . . . 0.0 110.566 177.027 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.42 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 15.4 t-80 -64.75 -50.98 64.74 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.0 pp -67.3 -32.2 73.03 Favored 'General case' 0 C--O 1.252 1.198 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.218 -174.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.817 HD21 HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -75.95 -31.48 59.08 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 178.268 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.491 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -64.51 -35.28 80.45 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.798 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 12.6 mt-10 -72.17 -40.55 67.89 Favored 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 120.304 -0.558 . . . . 0.0 109.985 179.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.75 -38.87 87.5 Favored 'General case' 0 C--O 1.212 -0.894 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.667 -179.103 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.623 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -68.69 -42.94 83.39 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.291 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -57.22 -51.75 68.07 Favored 'General case' 0 C--O 1.275 2.432 0 C-N-CA 124.64 1.176 . . . . 0.0 110.793 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.9 -36.9 85.87 Favored 'General case' 0 C--O 1.21 -0.988 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.674 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.3 mp -61.36 -39.82 84.06 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 O-C-N 123.451 0.469 . . . . 0.0 110.182 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.623 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 10.8 mt-30 -64.18 -49.9 70.23 Favored 'General case' 0 CA--C 1.496 -1.1 0 O-C-N 123.636 0.585 . . . . 0.0 110.286 -177.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.451 ' H ' ' HG2' ' A' ' 77' ' ' LYS . 0.8 OUTLIER -73.28 -28.22 61.99 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 118.786 -1.166 . . . . 0.0 113.922 179.377 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -64.58 -47.79 77.38 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.0 pp -64.93 -38.99 92.8 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.58 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 52.4 mt-10 -58.49 -54.45 46.94 Favored 'General case' 0 CA--C 1.49 -1.332 0 O-C-N 123.992 0.807 . . . . 0.0 110.302 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 86' ' ' ARG . 10.6 pt-20 -68.39 -39.05 81.86 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 120.312 -0.555 . . . . 0.0 112.127 -175.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.456 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -66.13 -34.17 77.45 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.687 -178.828 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 -77.73 -44.28 28.31 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.279 0.562 . . . . 0.0 110.095 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -81.68 -59.3 2.65 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -171.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 71.0 m -154.16 91.36 1.42 Allowed 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -169.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.432 ' CG ' ' HA ' ' A' ' 82' ' ' LYS . 12.1 ptm180 177.3 -34.78 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.427 1.891 . . . . 0.0 110.093 171.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 C--O 1.249 1.038 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.24 176.195 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.358 0 N-CA-C 110.634 -0.987 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 38.9 m -81.02 91.41 6.07 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 120.861 0.363 . . . . 0.0 111.641 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 95.5 mmm -83.39 -29.13 28.41 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 172.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 45.3 t -122.3 145.51 48.17 Favored 'General case' 0 N--CA 1.416 -2.167 0 N-CA-C 104.252 -2.499 . . . . 0.0 104.252 170.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -107.68 -70.93 0.78 Allowed 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.099 -177.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 61.8 t80 58.85 90.76 0.05 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 C-N-CA 125.083 1.353 . . . . 0.0 111.757 -178.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 131.98 -30.43 3.21 Favored Glycine 0 N--CA 1.426 -2.015 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -131.77 58.24 1.74 Allowed 'General case' 0 N--CA 1.435 -1.209 0 CA-C-O 122.083 0.944 . . . . 0.0 112.153 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -64.64 -31.57 72.85 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.847 176.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 110' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' B' ' 114' ' ' LEU . 3.4 t -58.88 -33.78 70.89 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.558 176.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 52.9 tp -68.25 -50.89 50.84 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -68.58 -41.97 78.92 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -62.06 -54.76 36.88 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 122.884 0.474 . . . . 0.0 110.211 -178.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' B' ' 110' ' ' THR . 1.2 mm? -66.38 -31.64 72.53 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.846 -0.616 . . . . 0.0 112.336 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 33.5 tp -65.38 -45.87 82.35 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 122.208 -0.307 . . . . 0.0 110.379 175.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 28.7 m -66.65 -39.74 88.36 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.149 0.5 . . . . 0.0 110.332 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 30.3 m -73.19 -22.5 60.45 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.426 0.631 . . . . 0.0 111.944 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -76.83 -34.83 57.87 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 122.106 0.955 . . . . 0.0 108.614 174.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 37.4 t -77.05 -10.31 59.29 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.231 178.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 13.6 tp -58.77 -12.56 4.46 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.132 1.773 . . . . 0.0 114.158 -174.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 14.3 p -53.92 -21.55 8.14 Favored 'General case' 0 CA--C 1.556 1.196 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 -170.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 14.4 p80 -78.55 62.39 3.13 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 -175.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 58.7 m 48.31 104.96 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -138.58 -176.69 4.56 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.105 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 161.29 174.04 30.67 Favored Glycine 0 N--CA 1.424 -2.102 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 106.15 104.43 2.94 Favored Glycine 0 C--N 1.303 -1.28 0 C-N-CA 120.223 -0.989 . . . . 0.0 112.585 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -178.97 -125.82 0.96 Allowed Glycine 0 N--CA 1.426 -1.992 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 48.7 m -153.18 119.22 5.43 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -72.71 171.29 50.26 Favored Glycine 0 C--O 1.242 0.621 0 C-N-CA 121.459 -0.4 . . . . 0.0 112.823 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -177.7 162.6 30.48 Favored Glycine 0 N--CA 1.437 -1.244 0 N-CA-C 111.556 -0.618 . . . . 0.0 111.556 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 146.55 -174.33 26.46 Favored Glycine 0 C--N 1.305 -1.156 0 N-CA-C 110.099 -1.2 . . . . 0.0 110.099 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 16.1 m 66.84 100.39 0.05 OUTLIER 'General case' 0 C--O 1.248 0.997 0 C-N-CA 124.611 1.164 . . . . 0.0 112.118 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -107.99 -102.84 2.81 Favored Glycine 0 N--CA 1.44 -1.065 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.957 -178.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 154.81 4.96 0.1 OUTLIER Glycine 0 C--N 1.308 -0.992 0 C-N-CA 120.713 -0.756 . . . . 0.0 114.153 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 97.63 75.84 1.25 Allowed Glycine 0 CA--C 1.524 0.653 0 C-N-CA 119.994 -1.098 . . . . 0.0 114.546 176.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 35.5 t -97.77 -135.4 0.26 Allowed 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 173.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.532 ' O ' ' HB2' ' B' ' 141' ' ' MET . 95.2 mt -53.64 -27.64 28.3 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 118.319 0.509 . . . . 0.0 111.448 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.476 ' CB ' ' HE2' ' B' ' 141' ' ' MET . 0.0 OUTLIER -68.09 -12.94 61.77 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -178.097 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 54.0 t -65.04 -31.27 72.42 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.085 0.554 . . . . 0.0 111.283 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -129.26 26.02 5.45 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 122.13 0.967 . . . . 0.0 109.901 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.532 ' HB2' ' O ' ' B' ' 137' ' ' LEU . 45.3 ttp -100.58 -9.93 21.49 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.045 -0.979 . . . . 0.0 112.47 -172.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -35.94 -65.96 0.23 Allowed 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.0 p -66.12 -33.92 76.88 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 121.243 0.544 . . . . 0.0 112.103 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 51.2 mm -67.0 -49.59 72.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.975 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.448 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 21.2 tt -69.7 -31.19 47.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.163 -177.276 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -57.81 -65.31 0.66 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 20.0 p -67.2 -45.6 76.38 Favored 'General case' 0 C--O 1.247 0.96 0 CA-C-N 114.441 -1.254 . . . . 0.0 113.517 -174.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -80.44 -34.41 36.09 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.491 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 9.1 tt -97.91 -32.05 11.88 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -170.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . 0.256 0.0 OUTLIER -152.69 157.75 41.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 115.545 -2.462 . . . . 0.0 116.784 -176.538 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -167.1 109.1 0.66 Allowed 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 113.924 -1.489 . . . . 0.0 108.886 178.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.308 -1.222 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 178.283 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.482 -2.012 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 33.8 m -101.62 141.19 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.336 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.143 177.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.538 ' H ' ' HD2' ' A' ' 3' ' ' ARG . 0.1 OUTLIER -96.13 34.92 1.5 Allowed 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 122.374 1.083 . . . . 0.0 109.665 -179.151 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.468 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 76.9 mttt -119.89 118.47 30.85 Favored 'General case' 0 N--CA 1.421 -1.89 0 CA-C-N 114.303 -1.317 . . . . 0.0 109.523 -173.158 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.01 -21.39 31.03 Favored Glycine 0 C--N 1.321 -0.252 0 CA-C-N 115.243 -0.89 . . . . 0.0 114.947 -176.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.468 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 55.7 p-90 -64.13 -14.69 56.69 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 117.365 0.583 . . . . 0.0 112.368 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -61.29 -12.88 15.21 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 176.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -81.76 -16.85 49.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.66 0.743 . . . . 0.0 109.833 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -105.32 18.69 21.86 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.825 -171.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.67 130.32 9.67 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.831 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.2 m -105.28 162.88 13.04 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 -177.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -58.15 -36.26 72.72 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 120.792 0.329 . . . . 0.0 110.406 177.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -58.41 -41.33 84.72 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.828 -0.623 . . . . 0.0 112.123 178.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.54 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -68.3 -52.06 37.89 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 -175.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.575 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.4 ptm180 -63.97 -43.84 94.56 Favored 'General case' 0 N--CA 1.415 -2.2 0 CA-C-N 114.301 -1.318 . . . . 0.0 112.849 -176.389 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 t -66.71 -28.3 68.32 Favored 'General case' 0 N--CA 1.44 -0.962 0 N-CA-C 110.237 -0.282 . . . . 0.0 110.237 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.7 t60 -68.02 -41.98 81.35 Favored 'General case' 0 C--O 1.241 0.644 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.78 HD23 HD21 ' A' ' 68' ' ' LEU . 5.0 mp -67.02 -40.67 87.29 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.173 -0.922 . . . . 0.0 109.704 177.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 15' ' ' ARG . 76.6 t -56.85 -47.9 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.049 0.94 . . . . 0.0 109.793 174.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.483 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 23.1 t-80 -54.85 -52.23 63.41 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.367 177.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.4 mttp -61.77 -39.76 92.8 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.428 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.479 ' O ' HG22 ' A' ' 26' ' ' ILE . 8.8 mt -52.37 -52.55 52.89 Favored 'General case' 0 CA--C 1.506 -0.748 0 C-N-CA 123.463 0.705 . . . . 0.0 111.0 175.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.2 t -54.92 -48.7 74.51 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.373 0 O-C-N 124.0 0.812 . . . . 0.0 109.869 176.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 40.2 mt-30 -57.55 -34.65 69.38 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -175.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.15 -45.54 15.0 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 176.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.531 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.6 -23.42 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 121.988 0.899 . . . . 0.0 110.439 -174.936 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD2' HG23 ' A' ' 26' ' ' ILE . 66.1 m-85 -133.2 84.62 47.22 Favored Pre-proline 0 C--N 1.284 -2.242 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.18 106.46 0.3 Allowed 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.636 2.224 . . . . 0.0 111.194 -177.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.408 HG21 HD21 ' A' ' 35' ' ' LEU . 7.4 t -83.73 137.16 41.34 Favored Pre-proline 0 N--CA 1.425 -1.709 0 CA-C-O 121.124 0.488 . . . . 0.0 111.625 -172.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.474 ' HD3' ' OG ' ' B' ' 121' ' ' SER . 73.7 Cg_endo -80.74 -19.93 8.21 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.787 2.325 . . . . 0.0 112.315 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -158.53 159.06 29.93 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.705 -176.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.568 ' HA ' HD12 ' A' ' 35' ' ' LEU . 58.6 Cg_endo -77.17 -1.46 11.63 Favored 'Trans proline' 0 N--CA 1.442 -1.504 0 C-N-CA 121.446 1.431 . . . . 0.0 113.876 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -95.34 -17.12 21.87 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.692 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.9 -16.05 63.66 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 122.189 0.995 . . . . 0.0 108.845 172.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 32' ' ' PRO . 33.3 mt -87.36 1.23 53.92 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.276 -1.329 . . . . 0.0 111.374 -179.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -133.04 24.16 4.22 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-O 122.407 1.099 . . . . 0.0 108.888 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.58 ' O ' ' HB3' ' A' ' 40' ' ' MET . 25.6 t70 -82.36 170.92 14.78 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 114.053 -1.43 . . . . 0.0 108.151 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.552 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.81 -25.5 62.89 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-O 121.903 0.859 . . . . 0.0 109.743 179.115 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.541 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 21.4 ttp180 -77.4 -15.78 59.18 Favored 'General case' 0 C--O 1.251 1.139 0 C-N-CA 124.442 1.097 . . . . 0.0 110.204 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.615 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.5 tpp -59.55 -32.94 70.8 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.068 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HA ' HG12 ' A' ' 44' ' ' VAL . 0.5 OUTLIER -62.32 -33.55 74.91 Favored 'General case' 0 C--O 1.184 -2.349 0 C-N-CA 119.003 -1.079 . . . . 0.0 110.595 -179.771 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -70.99 -46.14 62.79 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 121.266 0.555 . . . . 0.0 109.556 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 18.7 mt -59.36 -51.09 71.4 Favored 'General case' 0 C--O 1.245 0.868 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.11 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.615 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -72.86 -28.59 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.058 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.728 -177.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.37 -46.42 90.25 Favored 'General case' 0 C--O 1.246 0.896 0 N-CA-C 109.794 -0.446 . . . . 0.0 109.794 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.5 t80 -59.58 -47.04 87.12 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.773 173.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.78 -41.63 95.95 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.771 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -63.02 -46.27 88.37 Favored 'General case' 0 C--O 1.216 -0.676 0 O-C-N 123.46 0.475 . . . . 0.0 111.613 176.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.4 pttp -64.37 -38.81 92.36 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-O 121.631 0.729 . . . . 0.0 110.885 -176.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.427 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 51.7 t -72.1 -45.26 63.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.551 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.433 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.8 tm-20 -57.07 -45.33 83.36 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 177.106 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.02 -40.06 95.05 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.273 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -61.12 -52.93 62.82 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.173 0.511 . . . . 0.0 111.195 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.437 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -67.4 -30.35 70.1 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 178.475 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -63.06 -53.76 48.73 Favored 'General case' 0 C--O 1.196 -1.759 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -73.04 -20.97 60.88 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 122.048 -0.407 . . . . 0.0 111.463 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.8 t -77.67 -42.49 34.47 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.2 162.39 28.46 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -173.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -102.89 4.53 37.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.147 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.421 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 66.7 p -160.17 160.04 32.39 Favored 'General case' 0 CA--C 1.488 -1.439 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.07 -24.26 61.48 Favored 'General case' 0 C--O 1.206 -1.215 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.152 176.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -68.07 -47.81 67.27 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -61.45 -43.92 98.02 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.462 176.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -48.38 77.03 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 123.36 0.412 . . . . 0.0 110.389 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.528 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 0.3 OUTLIER -60.58 -45.93 92.11 Favored 'General case' 0 N--CA 1.433 -1.311 0 O-C-N 123.882 0.739 . . . . 0.0 110.32 177.785 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.654 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 20.4 m80 -67.41 -42.74 82.78 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -178.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.437 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.0 pp -71.27 -31.63 67.72 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.56 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.78 HD21 HD23 ' A' ' 18' ' ' LEU . 1.7 pp -73.83 -32.85 63.88 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 178.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.484 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.83 -37.31 87.18 Favored 'General case' 0 C--O 1.197 -1.703 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.225 175.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.654 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 69.9 mm-40 -64.16 -43.89 93.76 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-O 121.824 0.821 . . . . 0.0 110.25 177.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -69.88 -41.05 75.28 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.4 -177.469 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.501 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.8 tt -68.5 -34.66 66.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.43 0.634 . . . . 0.0 109.467 -178.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.581 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 39.1 t80 -57.49 -54.4 47.26 Favored 'General case' 0 C--O 1.261 1.682 0 C-N-CA 125.8 1.64 . . . . 0.0 109.318 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.2 ptpt -64.75 -33.84 76.93 Favored 'General case' 0 C--O 1.207 -1.157 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.376 -178.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.436 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -63.61 -38.8 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-O 120.652 0.263 . . . . 0.0 110.858 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.552 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 6.7 mt-30 -69.07 -44.36 72.73 Favored 'General case' 0 CA--C 1.501 -0.942 0 C-N-CA 120.535 -0.466 . . . . 0.0 111.294 -177.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.581 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -72.15 -28.19 63.08 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 118.42 -1.312 . . . . 0.0 112.005 177.453 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.86 -49.04 77.85 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 176.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.65 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -64.15 -42.3 96.81 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.879 -178.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.55 -45.13 95.46 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -75.39 -32.72 60.87 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.837 -0.745 . . . . 0.0 111.936 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.85 -38.26 88.4 Favored 'General case' 0 C--N 1.348 0.504 0 CA-C-O 121.01 0.433 . . . . 0.0 110.133 -178.852 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.44 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 48.3 ttp180 -77.84 -37.76 47.72 Favored 'General case' 0 N--CA 1.427 -1.617 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.608 178.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -77.02 -59.73 2.66 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 119.631 -0.828 . . . . 0.0 113.095 -176.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 67.7 m -169.29 110.56 0.47 Allowed 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -174.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.472 ' CD ' ' HA ' ' A' ' 82' ' ' LYS . 16.8 ptm180 -169.92 -34.44 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.573 0.749 . . . . 0.0 110.306 172.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 84.7 mt . . . . . 0 C--O 1.247 0.957 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.736 -178.406 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.677 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 70.0 m 65.22 33.75 9.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 122.044 0.926 . . . . 0.0 111.994 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.81 -10.07 57.54 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 173.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 32.7 t -143.7 105.23 4.3 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 173.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 47.9 m80 -76.03 92.42 3.17 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 121.527 0.68 . . . . 0.0 111.961 -178.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' TYR . . . . . 0.485 ' HA ' HE22 ' B' ' 109' ' ' GLN . 36.2 t80 -145.26 130.11 18.21 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 173.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 96.03 -40.78 2.54 Favored Glycine 0 N--CA 1.439 -1.103 0 N-CA-C 108.794 -1.722 . . . . 0.0 108.794 -175.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -117.01 70.35 0.77 Allowed 'General case' 0 N--CA 1.434 -1.265 0 CA-C-O 122.351 1.072 . . . . 0.0 111.928 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.485 HE22 ' HA ' ' B' ' 106' ' ' TYR . 1.2 mp0 -71.64 -35.84 70.52 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 173.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 11.1 p -55.56 -35.95 66.29 Favored 'General case' 0 N--CA 1.417 -2.077 0 CA-C-N 112.32 -2.218 . . . . 0.0 113.048 -177.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 57.5 tp -58.57 -64.31 0.97 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -71.16 -35.36 71.62 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.776 -0.369 . . . . 0.0 111.216 -177.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -61.93 -58.38 8.15 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.424 0.63 . . . . 0.0 110.201 -178.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.65 HD21 ' HB3' ' A' ' 79' ' ' LEU . 26.5 tp -73.56 -19.72 60.82 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.388 -175.353 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 63.3 tp -70.45 -41.67 72.52 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 172.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.6 m -72.24 -42.58 65.51 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.954 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.8 m -62.27 -34.6 76.88 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.245 0.545 . . . . 0.0 110.489 176.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 13.8 t70 -64.3 -43.87 93.38 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 177.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 38.3 m -64.25 -33.35 75.61 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.854 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.459 HD21 ' HD2' ' A' ' 39' ' ' ARG . 8.0 tt -62.67 -39.72 94.82 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 123.267 0.627 . . . . 0.0 110.327 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 121' ' ' SER . . . . . 0.474 ' OG ' ' HD3' ' A' ' 30' ' ' PRO . 33.3 t -75.47 -45.08 40.64 Favored 'General case' 0 C--O 1.256 1.399 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 177.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 70.6 t60 78.59 -38.32 0.23 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.312 1.445 . . . . 0.0 113.915 173.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 23.6 m -115.21 155.4 27.26 Favored 'General case' 0 C--N 1.311 -1.102 0 O-C-N 121.962 -0.461 . . . . 0.0 110.993 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -108.04 139.02 43.3 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 122.842 0.457 . . . . 0.0 111.517 -177.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 125' ' ' GLY . . . . . 0.441 ' N ' ' HA ' ' A' ' 30' ' ' PRO . . . -164.19 -168.48 26.33 Favored Glycine 0 N--CA 1.443 -0.866 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -102.37 135.84 12.48 Favored Glycine 0 N--CA 1.445 -0.732 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -96.1 70.84 0.9 Allowed Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.834 -0.698 . . . . 0.0 113.162 -177.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 8.5 p -79.52 115.1 18.95 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 122.667 0.387 . . . . 0.0 110.626 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -171.03 143.38 7.64 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -138.95 -132.43 2.95 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.654 -177.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 94.91 102.73 1.83 Allowed Glycine 0 C--N 1.317 -0.52 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 13.3 m -138.96 141.1 38.42 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -90.03 -106.94 1.25 Allowed Glycine 0 C--N 1.308 -0.975 0 N-CA-C 112.005 -0.438 . . . . 0.0 112.005 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 134' ' ' GLY . . . . . 0.423 ' N ' ' HG2' ' B' ' 138' ' ' GLU . . . 156.17 82.06 0.04 OUTLIER Glycine 0 N--CA 1.434 -1.461 0 C-N-CA 120.22 -0.99 . . . . 0.0 112.98 178.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -119.55 -42.24 0.54 Allowed Glycine 0 C--N 1.311 -0.854 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 27.7 t -146.67 -56.71 0.27 Allowed 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 74.5 mt -106.39 -36.77 6.72 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-O 121.48 0.657 . . . . 0.0 111.564 -177.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.451 ' H ' ' CD ' ' B' ' 138' ' ' GLU . 0.1 OUTLIER -71.23 -10.78 60.33 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -169.274 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 19.8 t -59.39 -58.27 9.35 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -174.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -139.99 72.07 1.39 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.44 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 23.5 ptt? -104.05 -32.26 9.29 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 -173.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.469 ' HA ' ' CG2' ' B' ' 145' ' ' ILE 0.339 38.6 mt-10 -37.19 -47.16 0.76 Allowed 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -168.012 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.6 m -64.26 -52.42 58.78 Favored 'General case' 0 C--O 1.267 1.991 0 CA-C-O 121.705 0.764 . . . . 0.0 110.169 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 46.3 mm -64.53 -51.54 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.098 -176.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.528 ' HA ' ' OH ' ' A' ' 65' ' ' TYR . 10.7 tt -58.76 -43.74 88.63 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.688 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.747 -177.424 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -61.59 -45.7 93.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.264 0.078 . . . . 0.0 110.852 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 20.8 p -66.54 -32.24 73.47 Favored 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -80.73 -31.36 36.06 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.283 0.563 . . . . 0.0 110.308 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 12.8 tp -68.21 -54.66 16.22 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.673 -175.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -164.92 -175.66 3.85 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.093 -171.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -131.84 -66.02 0.73 Allowed 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 175.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.407 -2.617 0 N-CA-C 101.048 -3.686 . . . . 0.0 101.048 -179.568 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.5 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.4 m -89.52 124.44 42.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.544 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -86.88 61.94 7.1 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 122.921 1.343 . . . . 0.0 111.2 -176.844 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HD3' ' NE1' ' A' ' 6' ' ' TRP . 14.3 ptpt -148.0 107.69 3.98 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 114.108 -1.405 . . . . 0.0 109.21 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.94 -25.9 32.26 Favored Glycine 0 C--O 1.239 0.439 0 CA-C-N 114.783 -1.099 . . . . 0.0 115.11 -172.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.48 ' NE1' ' HD3' ' A' ' 4' ' ' LYS . 67.3 p-90 -66.72 -4.66 9.48 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -64.47 -21.44 66.66 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.07 0.462 . . . . 0.0 111.081 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -89.33 0.14 57.03 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.776 0.798 . . . . 0.0 110.065 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -106.4 6.53 30.46 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.388 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.42 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.3 p -136.02 111.08 11.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 CA-C-N 115.312 -0.858 . . . . 0.0 108.955 -178.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 m -81.72 152.85 26.84 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.834 -175.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -56.29 -37.96 70.58 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.309 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -63.57 -33.88 76.57 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.537 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.0 tm? -70.6 -52.25 22.72 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -176.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.551 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -65.03 -42.73 94.09 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.843 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.7 t -63.99 -31.26 72.38 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 178.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.538 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 31.0 t60 -69.66 -40.19 76.59 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.204 0.526 . . . . 0.0 109.714 178.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.703 HD23 HD21 ' A' ' 68' ' ' LEU . 5.5 mp -65.57 -41.34 93.04 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.997 176.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 15' ' ' ARG . 69.8 t -57.13 -49.04 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 123.822 0.849 . . . . 0.0 109.628 174.394 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -52.28 -52.4 52.98 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.869 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 58.0 mttm -63.79 -41.06 98.0 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.805 178.514 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.536 ' O ' HG22 ' A' ' 26' ' ' ILE . 15.1 mt -50.7 -51.94 44.91 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 123.966 0.791 . . . . 0.0 109.949 176.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.719 HG11 ' HE1' ' A' ' 40' ' ' MET . 72.5 t -56.89 -51.04 73.12 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.697 0 O-C-N 124.206 0.941 . . . . 0.0 111.423 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -54.02 -37.64 64.3 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.508 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -82.17 -46.65 13.5 Favored 'General case' 0 C--O 1.21 -0.997 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 177.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.556 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.51 -22.21 16.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.66 0 CA-C-O 122.051 0.929 . . . . 0.0 110.102 -174.345 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.576 ' CG ' HD22 ' A' ' 43' ' ' LEU . 58.4 m-85 -130.58 84.1 60.08 Favored Pre-proline 0 C--N 1.275 -2.652 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.631 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.415 ' HG2' ' HA ' ' B' ' 118' ' ' ASP . 19.8 Cg_endo -59.25 107.01 0.33 Allowed 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.865 1.71 . . . . 0.0 109.874 179.027 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.2 t -84.42 149.08 54.1 Favored Pre-proline 0 C--N 1.29 -1.993 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.055 -174.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.56 -28.61 14.19 Favored 'Trans proline' 0 C--O 1.243 0.737 0 C-N-CA 122.404 2.069 . . . . 0.0 111.427 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -155.7 161.06 30.27 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.243 -177.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 35' ' ' LEU . 57.0 Cg_endo -78.72 -3.5 13.33 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 121.931 1.754 . . . . 0.0 114.623 -177.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.55 ' O ' ' HG2' ' A' ' 36' ' ' LYS . . . -96.89 -16.97 20.45 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.245 0.545 . . . . 0.0 109.868 177.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.621 ' HA ' ' OD2' ' A' ' 37' ' ' ASP . . . -66.06 -17.02 64.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 122.466 1.127 . . . . 0.0 108.828 173.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 32' ' ' PRO . 55.8 mt -80.81 5.42 16.02 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 113.458 -1.701 . . . . 0.0 111.056 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 15.6 ptpt -133.82 6.19 3.69 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.179 0.514 . . . . 0.0 110.722 173.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.621 ' OD2' ' HA ' ' A' ' 34' ' ' ALA . 69.6 m-20 -85.25 179.71 7.16 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.826 178.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.488 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.4 OUTLIER -59.18 -24.83 63.41 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.307 0.643 . . . . 0.0 111.836 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.638 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 22.6 tpp180 -65.27 -35.65 81.69 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.092 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.848 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.1 tpp -59.59 -35.07 73.59 Favored 'General case' 0 C--O 1.191 -1.986 0 CA-C-N 114.715 -1.129 . . . . 0.0 112.693 -177.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 13.9 pt-20 -60.92 -32.92 72.39 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.475 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -78.57 -43.89 25.48 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.18 0.514 . . . . 0.0 110.133 178.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 16.5 mt -60.77 -50.95 71.4 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.583 -178.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.848 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.5 p -68.84 -32.95 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.59 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.049 -179.015 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.13 -46.42 82.68 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-O 120.759 0.314 . . . . 0.0 110.552 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.8 t80 -61.67 -46.75 88.4 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.044 174.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.73 -37.84 88.16 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 120.319 -0.553 . . . . 0.0 111.543 -176.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 91.8 mttt -66.74 -43.1 85.09 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 123.232 0.613 . . . . 0.0 111.501 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.9 pttp -67.27 -37.29 83.2 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.549 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 37.3 t -71.26 -48.0 56.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.603 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.3 tm-20 -57.55 -48.25 79.81 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 123.428 0.691 . . . . 0.0 109.584 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.41 -35.17 91.31 Favored Glycine 0 C--N 1.332 0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.308 178.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -63.52 -52.51 60.89 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 122.729 0.412 . . . . 0.0 110.273 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.461 ' H ' ' HG2' ' A' ' 54' ' ' MET . 0.0 OUTLIER -67.86 -30.61 70.03 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 177.883 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -62.6 -41.48 99.0 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 175.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -78.81 -21.84 47.11 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.862 178.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.5 t -84.48 -29.46 26.01 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-O 121.164 0.507 . . . . 0.0 110.869 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.95 166.67 13.77 Favored 'General case' 0 C--O 1.245 0.84 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -176.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -116.72 6.93 13.35 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.416 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.6 p -157.99 158.34 34.71 Favored 'General case' 0 CA--C 1.475 -1.918 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 173.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.42 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.4 -26.21 61.79 Favored 'General case' 0 C--O 1.2 -1.522 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.926 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -66.18 -45.08 82.13 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -62.14 -46.78 87.49 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.15 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.41 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -65.28 -47.4 76.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.816 -0.175 . . . . 0.0 110.928 -177.335 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -58.96 -46.09 88.9 Favored 'General case' 0 C--O 1.208 -1.11 0 C-N-CA 123.459 0.704 . . . . 0.0 110.091 176.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -64.28 -49.61 71.15 Favored 'General case' 0 C--O 1.213 -0.84 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.445 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.3 pp -68.09 -32.51 72.87 Favored 'General case' 0 C--O 1.255 1.395 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.609 -176.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.703 HD21 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -74.47 -35.05 63.27 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.506 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -62.8 -37.46 86.79 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.535 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -64.3 -44.51 91.4 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.954 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -42.23 79.33 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.859 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 7.0 tt -63.49 -44.14 98.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.564 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.491 ' CD2' ' HB2' ' B' ' 150' ' ' MET . 35.7 t80 -55.3 -54.19 46.69 Favored 'General case' 0 C--O 1.259 1.582 0 C-N-CA 124.97 1.308 . . . . 0.0 110.035 -179.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -65.12 -32.02 73.51 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.597 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -67.77 -40.94 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 122.96 0.504 . . . . 0.0 111.189 178.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.542 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 43.2 mt-30 -66.21 -39.56 89.71 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.379 0.609 . . . . 0.0 109.425 -179.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.679 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS 0.267 0.0 OUTLIER -71.86 -27.21 62.72 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 174.134 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.514 ' OE1' HD23 ' B' ' 114' ' ' LEU . 2.2 tm-20 -64.9 -52.21 57.71 Favored 'General case' 0 C--N 1.309 -1.196 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.455 ' HA ' ' CG ' ' A' ' 82' ' ' LYS . 4.7 pp -62.16 -37.03 83.64 Favored 'General case' 0 C--O 1.248 1.015 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.142 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.599 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 12.9 pt-20 -65.93 -44.89 83.76 Favored 'General case' 0 N--CA 1.439 -1.0 0 C-N-CA 119.791 -0.763 . . . . 0.0 110.606 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -70.61 -43.34 69.5 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.54 -177.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.566 ' HA ' ' CG ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -62.19 -46.35 89.31 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -177.255 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 25.5 ttm180 -77.0 -32.59 57.31 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 123.359 0.412 . . . . 0.0 110.594 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -70.32 -56.68 6.12 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -177.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 t -166.48 89.96 0.4 Allowed 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.566 ' CG ' ' HA ' ' A' ' 82' ' ' LYS . 13.7 ptm180 -179.47 -30.65 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.012 1.725 . . . . 0.0 109.732 169.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.9 mp . . . . . 0 N--CA 1.47 0.55 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 173.856 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.85 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 32.8 t -70.82 -36.16 72.81 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 123.287 0.635 . . . . 0.0 111.026 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 96.4 mmm -91.4 -8.47 47.82 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.83 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 39.9 m -62.98 126.1 26.21 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 42.4 m80 77.75 -33.48 0.18 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.804 1.242 . . . . 0.0 112.447 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -81.5 -17.69 47.73 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.974 0.416 . . . . 0.0 111.027 178.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -88.27 -69.5 1.28 Allowed Glycine 0 N--CA 1.423 -2.178 0 N-CA-C 108.686 -1.766 . . . . 0.0 108.686 173.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -84.35 66.27 9.3 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 122.273 1.035 . . . . 0.0 111.554 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -67.63 -44.41 78.06 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 113.732 -1.576 . . . . 0.0 108.652 177.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 3.4 p -57.92 -38.89 76.71 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.478 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 47.7 tp -58.0 -52.82 63.91 Favored 'General case' 0 C--O 1.247 0.949 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.237 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -72.44 -41.77 65.77 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 123.523 0.515 . . . . 0.0 112.044 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -57.31 -55.45 34.62 Favored 'General case' 0 CA--C 1.498 -1.043 0 CA-C-O 121.534 0.683 . . . . 0.0 109.486 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.514 HD23 ' OE1' ' A' ' 78' ' ' GLU . 26.6 tp -69.62 -26.15 64.29 Favored 'General case' 0 C--O 1.183 -2.433 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.563 -175.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 35.8 tp -70.96 -36.05 72.41 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-N 118.926 0.785 . . . . 0.0 109.995 175.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 31.5 m -64.93 -36.13 83.4 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 16.1 m -76.66 -36.3 57.42 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.972 176.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.415 ' HA ' ' HG2' ' A' ' 28' ' ' PRO . 29.5 t70 -57.67 -36.59 72.11 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 125.327 1.451 . . . . 0.0 110.491 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 22.1 m -63.97 -10.4 21.22 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.598 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 64.8 tp -65.66 -57.65 7.6 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 3.4 p -77.52 -45.49 25.29 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.852 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 76.7 t60 71.95 -56.4 0.64 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.075 1.35 . . . . 0.0 110.582 -176.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 13.9 t -117.53 150.09 39.54 Favored 'General case' 0 N--CA 1.419 -2.016 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 32.7 t70 78.44 128.85 0.05 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 125.388 1.475 . . . . 0.0 111.901 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -157.35 -155.1 7.35 Favored Glycine 0 C--O 1.246 0.892 0 N-CA-C 111.579 -0.608 . . . . 0.0 111.579 -178.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -123.03 174.84 16.51 Favored Glycine 0 N--CA 1.44 -1.055 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.833 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -176.81 91.45 0.08 OUTLIER Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 68.1 m -157.07 173.0 17.66 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -114.93 -130.64 4.9 Favored Glycine 0 N--CA 1.424 -2.107 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 177.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -154.57 -119.48 0.7 Allowed Glycine 0 N--CA 1.424 -2.117 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 162.84 -135.44 3.84 Favored Glycine 0 C--N 1.299 -1.48 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 34.5 p -148.48 103.86 3.45 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -127.89 163.95 21.39 Favored Glycine 0 N--CA 1.433 -1.511 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.866 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 175.73 152.91 9.85 Favored Glycine 0 N--CA 1.434 -1.496 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 178.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 160.32 -54.97 0.33 Allowed Glycine 0 C--N 1.311 -0.845 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.441 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 23.1 t -157.17 147.67 21.25 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.023 -1.843 . . . . 0.0 106.023 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.648 ' O ' ' HB3' ' B' ' 141' ' ' MET . 1.5 pt? -105.85 -58.12 1.95 Allowed 'General case' 0 C--O 1.201 -1.48 0 C-N-CA 120.155 -0.618 . . . . 0.0 112.574 -178.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -83.9 -17.09 41.92 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 -174.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 58.1 m -74.71 -60.34 2.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 120.327 -0.549 . . . . 0.0 109.589 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -145.12 109.39 4.87 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 174.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.648 ' HB3' ' O ' ' B' ' 137' ' ' LEU . 24.4 ptp -102.39 -33.07 9.69 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.254 -172.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.435 ' H ' ' CD ' ' B' ' 142' ' ' GLU . 1.1 mp0 -17.98 -70.28 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 127.524 2.33 . . . . 0.0 115.84 -172.528 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 50.1 m -72.94 -38.66 66.73 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 120.94 0.4 . . . . 0.0 111.373 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 78.9 mt -65.97 -53.4 38.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.196 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 19.8 tt -65.55 -31.69 54.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.139 -177.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.406 ' HG3' ' HB3' ' B' ' 151' ' ' ASP . 38.8 ttm180 -59.93 -51.22 70.62 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.8 p -69.41 -39.33 77.99 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -80.95 -52.91 6.92 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.506 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 7.3 tt -96.39 -17.77 20.39 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.869 -171.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.491 ' HB2' ' CD2' ' A' ' 73' ' ' TYR . 26.4 ttt 79.72 111.54 0.07 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 122.166 0.984 . . . . 0.0 111.213 -177.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 151' ' ' ASP . . . . . 0.406 ' HB3' ' HG3' ' B' ' 146' ' ' ARG . 13.8 t70 -110.51 -60.69 1.78 Allowed 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.376 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 C-N-CA 127.364 2.266 . . . . 0.0 105.1 179.084 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.932 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -88.62 135.48 25.6 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.224 0 CA-C-N 117.538 0.669 . . . . 0.0 110.116 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -84.68 102.29 12.85 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 120.952 0.405 . . . . 0.0 111.725 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.6 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 15.6 ptpt -152.35 88.36 1.36 Allowed 'General case' 0 N--CA 1.422 -1.85 0 CA-C-O 121.98 0.895 . . . . 0.0 111.883 175.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.19 -2.97 10.24 Favored Glycine 0 CA--C 1.508 -0.355 0 CA-C-N 114.197 -1.365 . . . . 0.0 114.907 -175.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.6 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 63.7 p-90 -68.35 -11.83 60.17 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 117.391 0.595 . . . . 0.0 110.771 176.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -60.75 -25.15 66.28 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.237 0.541 . . . . 0.0 110.345 176.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -77.69 -4.51 46.49 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 121.141 0.496 . . . . 0.0 110.64 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.7 m-70 -111.61 10.6 21.15 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 121.167 0.508 . . . . 0.0 110.664 -177.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.7 p -138.71 110.39 5.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 CA-C-O 122.043 0.925 . . . . 0.0 109.261 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.9 m -81.3 156.23 25.63 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.031 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.7 tm0? -52.0 -37.96 55.09 Favored 'General case' 0 C--O 1.204 -1.338 0 C-N-CA 124.23 1.012 . . . . 0.0 110.509 176.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -60.54 -38.42 84.43 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.542 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -69.87 -50.0 46.8 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 -176.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.571 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.9 OUTLIER -65.23 -46.39 80.81 Favored 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 114.362 -1.29 . . . . 0.0 112.888 -177.894 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.8 t -66.4 -26.7 67.37 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.015 0.436 . . . . 0.0 110.03 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.438 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 10.2 t60 -64.8 -49.81 69.23 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 176.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.738 HD23 HD21 ' A' ' 68' ' ' LEU . 4.5 mp -63.7 -39.46 94.37 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.197 177.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 15' ' ' ARG . 65.8 t -58.35 -51.85 66.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 124.077 0.951 . . . . 0.0 110.897 175.35 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -54.28 -45.42 72.47 Favored 'General case' 0 C--O 1.254 1.303 0 C-N-CA 123.705 0.802 . . . . 0.0 110.482 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -66.78 -39.56 87.85 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.901 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.486 ' O ' HG22 ' A' ' 26' ' ' ILE . 30.1 mt -51.14 -50.58 58.62 Favored 'General case' 0 CA--C 1.5 -0.977 0 O-C-N 123.76 0.663 . . . . 0.0 109.963 175.065 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.541 HG13 ' HB3' ' A' ' 43' ' ' LEU . 73.8 t -54.19 -53.47 28.79 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.89 0 O-C-N 124.285 0.99 . . . . 0.0 110.353 176.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -51.91 -37.41 52.41 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -178.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.16 -46.31 13.95 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 178.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.486 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -75.92 -21.97 15.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.856 0.836 . . . . 0.0 110.422 -174.256 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.481 ' CD2' HG23 ' A' ' 26' ' ' ILE . 42.2 m-85 -133.98 89.72 28.51 Favored Pre-proline 0 N--CA 1.412 -2.333 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.412 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -59.76 100.47 0.14 Allowed 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.019 1.813 . . . . 0.0 110.383 176.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -67.84 138.04 92.79 Favored Pre-proline 0 N--CA 1.428 -1.545 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.762 -172.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.511 ' HB3' ' O ' ' B' ' 121' ' ' SER . 18.6 Cg_endo -64.34 -30.38 63.29 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.825 2.35 . . . . 0.0 111.832 178.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.512 ' HB2' ' O ' ' B' ' 124' ' ' ASP . 22.2 t70 -161.79 150.03 12.46 Favored Pre-proline 0 CA--C 1.503 -0.838 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 -176.163 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.434 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 7.6 Cg_endo -54.73 -25.05 40.44 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 122.579 2.186 . . . . 0.0 113.717 174.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.96 -11.72 59.84 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 121.21 -0.931 . . . . 0.0 112.029 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.69 -9.38 59.8 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.761 0.791 . . . . 0.0 109.258 177.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.434 ' CD1' ' HA ' ' A' ' 32' ' ' PRO . 22.6 mt -87.84 -0.07 56.48 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.711 -178.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.411 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -133.86 15.3 3.94 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.967 0.889 . . . . 0.0 110.205 178.027 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.644 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 30.9 t70 -94.25 179.73 5.21 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.16 -178.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.644 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.7 -25.15 62.83 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 120.591 0.234 . . . . 0.0 110.75 177.959 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.642 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 15.4 tpp180 -57.87 -34.65 69.98 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 174.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.749 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.7 tpp -60.38 -36.98 79.35 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-N 114.613 -1.176 . . . . 0.0 113.133 -178.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.8 pt-20 -62.65 -31.43 72.3 Favored 'General case' 0 C--O 1.202 -1.431 0 C-N-CA 118.528 -1.269 . . . . 0.0 110.165 -177.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -74.23 -47.42 35.35 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-O 121.77 0.795 . . . . 0.0 110.099 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 20.4 mt -63.54 -46.46 85.89 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.704 -177.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.749 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.2 p -71.86 -27.86 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.534 -178.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.9 -47.6 84.41 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.55 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.9 t80 -60.09 -46.26 90.18 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.23 173.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.15 97.83 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.367 -176.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -65.09 -39.36 93.07 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 123.603 0.761 . . . . 0.0 111.629 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.7 pttp -70.96 -38.54 72.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.527 0.68 . . . . 0.0 109.923 -177.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.485 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 42.8 t -73.66 -43.2 54.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.915 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.416 ' HG3' HG23 ' A' ' 19' ' ' VAL . 11.0 tm-20 -59.44 -45.3 91.98 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.88 -41.37 94.14 Favored Glycine 0 C--O 1.221 -0.696 0 O-C-N 123.663 0.602 . . . . 0.0 112.281 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.9 -54.34 48.06 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.104 0.562 . . . . 0.0 111.195 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.482 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -67.24 -34.13 76.81 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.673 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -62.37 -43.37 98.98 Favored 'General case' 0 C--O 1.2 -1.521 0 C-N-CA 123.754 0.822 . . . . 0.0 109.083 176.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -81.6 -15.29 55.17 Favored 'General case' 0 C--N 1.311 -1.076 0 O-C-N 121.414 -0.804 . . . . 0.0 112.035 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.5 t -85.43 -44.37 12.8 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 122.264 -0.273 . . . . 0.0 111.716 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.94 163.63 24.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 -175.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -105.59 -2.42 23.52 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.686 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.2 m -153.5 157.71 40.23 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.483 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -71.8 -34.75 69.62 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 119.885 -0.726 . . . . 0.0 111.113 177.774 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -62.06 -39.28 91.86 Favored 'General case' 0 C--O 1.205 -1.245 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -65.35 -48.48 72.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.535 177.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -44.96 92.35 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 123.434 0.459 . . . . 0.0 110.197 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -60.53 -44.76 95.72 Favored 'General case' 0 C--O 1.208 -1.088 0 O-C-N 123.829 0.706 . . . . 0.0 110.249 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -58.8 -55.78 30.64 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.326 0.65 . . . . 0.0 111.03 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.482 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.5 pp -67.4 -33.72 75.76 Favored 'General case' 0 C--O 1.249 1.061 0 CA-C-O 121.058 0.456 . . . . 0.0 112.096 -175.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.738 HD21 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -74.98 -32.39 61.67 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.471 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.44 -39.54 94.75 Favored 'General case' 0 C--O 1.21 -1.001 0 CA-C-N 115.296 -0.866 . . . . 0.0 109.573 176.269 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -63.43 -46.22 87.32 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.903 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.492 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.01 -40.75 78.51 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.746 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.524 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -65.13 -44.83 95.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.285 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -56.54 -49.59 74.35 Favored 'General case' 0 C--O 1.264 1.817 0 C-N-CA 124.823 1.249 . . . . 0.0 110.876 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -66.76 -33.25 75.21 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.898 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.492 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -64.29 -39.58 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 176.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.524 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 5.6 mt-30 -63.15 -46.03 89.12 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.294 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.591 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -68.83 -31.04 69.74 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 118.901 -1.12 . . . . 0.0 113.507 177.995 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.5 tp10 -61.2 -52.33 65.26 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.509 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -61.46 -43.59 98.6 Favored 'General case' 0 C--O 1.243 0.734 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -177.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.499 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 11.4 pt-20 -69.7 -44.03 71.22 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 119.697 -0.801 . . . . 0.0 112.358 -177.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -73.47 -32.91 64.58 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.504 -178.442 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.591 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -66.49 -40.54 89.33 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.22 179.214 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.591 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 19.9 tpp180 -77.93 -25.1 48.14 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.912 -178.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 32.9 ttm180 -95.01 -58.55 2.12 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.2 m -160.39 102.02 1.38 Allowed 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -172.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.489 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 3.2 ptp180 -164.6 -33.2 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 123.198 0.599 . . . . 0.0 110.636 168.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.441 ' HG ' ' HG3' ' A' ' 86' ' ' ARG . 49.3 mt . . . . . 0 C--O 1.246 0.921 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -178.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.063 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 15.0 m -73.3 112.3 9.24 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 14.5 tpt -79.28 -30.1 42.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.564 0.697 . . . . 0.0 109.55 -177.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' SER . . . . . 0.51 ' HB3' ' H ' ' B' ' 108' ' ' ASN . 27.3 m -93.39 100.4 12.72 Favored 'General case' 0 N--CA 1.418 -2.027 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.427 177.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -84.99 101.41 12.35 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 65.65 -0.02 1.35 Allowed 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 114.865 1.431 . . . . 0.0 114.865 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.32 -81.89 0.83 Allowed Glycine 0 N--CA 1.429 -1.772 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 175.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.51 ' H ' ' HB3' ' B' ' 104' ' ' SER . 94.7 m-20 -98.8 79.99 2.47 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.774 0.797 . . . . 0.0 112.067 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -83.57 -42.71 16.48 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.345 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 28.7 m -59.51 -47.19 86.49 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-N 114.527 -1.215 . . . . 0.0 111.358 -176.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 63.4 tp -54.15 -50.92 65.87 Favored 'General case' 0 C--O 1.21 -0.98 0 O-C-N 123.897 0.748 . . . . 0.0 111.77 -178.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -71.61 -41.15 69.26 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -174.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.01 -40.54 65.1 Favored 'General case' 0 C--O 1.246 0.873 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.449 -178.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.509 HD21 ' HB3' ' A' ' 79' ' ' LEU . 42.9 tp -72.34 -23.08 61.09 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.412 178.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.8 tp -66.43 -41.39 89.28 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 172.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 28.7 m -58.96 -41.93 88.69 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.2 m -66.66 -41.11 88.69 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-O 121.301 0.572 . . . . 0.0 111.154 175.443 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.3 -31.77 72.41 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.26 1.024 . . . . 0.0 110.347 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 19.8 m -77.25 -16.65 58.93 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.628 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.484 ' O ' HD23 ' B' ' 120' ' ' LEU . 6.8 tt -87.26 -21.98 25.46 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 121' ' ' SER . . . . . 0.511 ' O ' ' HB3' ' A' ' 30' ' ' PRO . 9.4 t -57.8 -57.82 11.1 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.974 -175.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 63.5 m80 67.28 -48.08 0.49 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.332 1.053 . . . . 0.0 113.817 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 32.7 m 77.34 95.63 0.06 Allowed 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.181 1.793 . . . . 0.0 109.209 -174.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.512 ' O ' ' HB2' ' A' ' 31' ' ' ASP . 19.9 t70 -148.14 128.59 13.99 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 -176.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -97.84 147.4 18.59 Favored Glycine 0 C--N 1.306 -1.096 0 N-CA-C 115.259 0.864 . . . . 0.0 115.259 -171.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -140.3 -52.99 0.04 OUTLIER Glycine 0 C--N 1.3 -1.465 0 N-CA-C 108.837 -1.705 . . . . 0.0 108.837 177.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 96.96 122.98 4.41 Favored Glycine 0 N--CA 1.427 -1.904 0 N-CA-C 114.259 0.463 . . . . 0.0 114.259 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 62.4 m -163.33 169.28 19.3 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 124.467 1.107 . . . . 0.0 110.002 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -92.4 -118.03 2.45 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 110.927 -0.869 . . . . 0.0 110.927 177.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.13 145.31 6.84 Favored Glycine 0 C--N 1.306 -1.134 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -144.97 144.08 12.72 Favored Glycine 0 C--N 1.306 -1.119 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.036 -178.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 33.7 m -134.01 114.32 13.09 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -160.08 169.19 35.93 Favored Glycine 0 N--CA 1.432 -1.617 0 N-CA-C 110.364 -1.095 . . . . 0.0 110.364 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 134' ' ' GLY . . . . . 0.471 ' C ' ' HG2' ' B' ' 138' ' ' GLU . . . 89.53 162.13 38.13 Favored Glycine 0 N--CA 1.432 -1.571 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 135' ' ' GLY . . . . . 0.451 ' N ' ' HG2' ' B' ' 138' ' ' GLU . . . 141.46 -129.71 4.12 Favored Glycine 0 N--CA 1.417 -2.602 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.995 179.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 5.1 m -139.57 -50.74 0.51 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.018 0.913 . . . . 0.0 109.076 -177.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 40.0 mt -79.99 -13.82 59.04 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.663 1.185 . . . . 0.0 110.059 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.561 ' HA ' ' SD ' ' B' ' 141' ' ' MET . 0.0 OUTLIER -56.0 -13.06 1.69 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 116.891 2.182 . . . . 0.0 116.891 -172.98 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 54.8 m -49.39 -51.34 35.57 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.384 0.674 . . . . 0.0 112.086 -175.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -154.43 74.58 0.96 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 172.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.561 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 24.4 ptm -101.96 -21.26 14.54 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.481 -175.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.425 ' HA ' HG22 ' B' ' 145' ' ' ILE . 22.0 mm-40 -37.89 -54.9 1.25 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 117.405 2.372 . . . . 0.0 117.405 -175.479 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 16.2 t -71.26 -30.81 66.75 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 119.749 -0.781 . . . . 0.0 110.317 -177.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 49.1 mm -74.82 -44.5 45.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.708 -179.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.425 HG22 ' HA ' ' B' ' 142' ' ' GLU . 18.5 tt -69.11 -31.32 49.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 CA-C-O 120.754 0.312 . . . . 0.0 110.248 -179.18 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.483 ' HD3' ' O ' ' B' ' 150' ' ' MET . 4.0 tpp180 -63.4 -61.51 2.3 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 173.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 40.3 t -55.01 -53.76 51.66 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.575 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -81.93 -46.1 14.5 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -172.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 72' ' ' ILE . 10.4 tt -93.17 -34.67 13.52 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -169.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.483 ' O ' ' HD3' ' B' ' 146' ' ' ARG . 26.1 ptm -169.95 110.07 0.41 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 118.561 -1.256 . . . . 0.0 113.253 -174.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -87.56 151.26 23.13 Favored 'General case' 0 C--N 1.285 -2.216 0 CA-C-N 114.465 -1.243 . . . . 0.0 109.875 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.249 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 -179.152 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.832 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 33.8 m -132.95 152.89 36.85 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.697 0 CA-C-O 121.736 0.779 . . . . 0.0 112.264 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.513 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -114.76 102.52 10.09 Favored 'General case' 0 N--CA 1.413 -2.307 0 N-CA-C 103.183 -2.895 . . . . 0.0 103.183 170.405 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.432 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 13.4 ptpt -84.22 99.48 10.57 Favored 'General case' 0 C--N 1.286 -2.194 0 C-N-CA 119.66 -0.816 . . . . 0.0 113.022 -171.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.45 -14.59 28.18 Favored Glycine 0 C--O 1.238 0.367 0 CA-C-N 113.762 -1.563 . . . . 0.0 115.079 -175.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.432 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 69.4 p-90 -73.69 -3.01 25.65 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 122.242 -0.564 . . . . 0.0 111.992 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 -62.91 -24.0 67.63 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 121.153 0.502 . . . . 0.0 110.971 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -79.19 -20.75 47.61 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.572 0.701 . . . . 0.0 109.786 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -90.29 2.84 55.07 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.649 -1.159 . . . . 0.0 110.116 -174.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.483 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.4 p -132.64 123.86 50.09 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.774 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 m -87.81 154.4 20.57 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.874 -175.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -55.5 -43.25 75.47 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 172.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -62.08 -32.59 73.15 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.499 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.501 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.24 -52.15 15.07 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 -177.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.541 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.4 ptm180 -63.79 -42.74 97.67 Favored 'General case' 0 N--CA 1.425 -1.698 0 CA-C-N 114.618 -1.174 . . . . 0.0 112.844 -178.135 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.1 t -65.66 -33.53 76.1 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.242 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -64.24 -44.41 91.91 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.757 HD23 HD21 ' A' ' 68' ' ' LEU . 4.8 mp -64.82 -39.45 93.61 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.235 178.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 15' ' ' ARG . 65.1 t -58.32 -51.04 76.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.512 0.725 . . . . 0.0 110.01 174.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.423 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 16.4 t-80 -51.98 -47.27 64.92 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 124.23 1.012 . . . . 0.0 110.503 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.622 ' HD3' HD22 ' B' ' 149' ' ' LEU . 40.3 mttm -68.71 -41.14 79.52 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.593 178.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.476 ' O ' HG22 ' A' ' 26' ' ' ILE . 31.6 mt -51.32 -50.27 59.73 Favored 'General case' 0 CA--C 1.501 -0.923 0 O-C-N 123.931 0.769 . . . . 0.0 109.743 175.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 43' ' ' LEU . 46.2 t -53.69 -53.78 23.74 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.577 0 O-C-N 124.549 1.155 . . . . 0.0 110.199 175.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.423 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 97.9 mt-30 -51.14 -39.38 56.14 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -177.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.43 ' HB3' HG13 ' A' ' 72' ' ' ILE . . . -81.71 -46.35 14.4 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.504 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.03 -23.8 17.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.881 0.848 . . . . 0.0 109.674 -174.637 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.538 ' CG ' HD22 ' A' ' 43' ' ' LEU . 50.6 m-85 -136.65 87.99 20.01 Favored Pre-proline 0 N--CA 1.408 -2.558 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.014 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.467 ' O ' ' HB2' ' B' ' 121' ' ' SER . 9.6 Cg_endo -55.56 113.36 1.39 Allowed 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 121.583 1.522 . . . . 0.0 109.426 174.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -77.1 137.23 65.31 Favored Pre-proline 0 N--CA 1.42 -1.971 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.725 -176.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.573 ' HA ' ' O ' ' B' ' 123' ' ' SER . 71.6 Cg_endo -73.43 -25.72 15.01 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.937 2.424 . . . . 0.0 111.814 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -151.97 144.41 16.74 Favored Pre-proline 0 CA--C 1.497 -1.087 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -177.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -60.25 -22.96 72.59 Favored 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.115 1.876 . . . . 0.0 113.131 175.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.55 -3.26 57.51 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 121.348 -0.845 . . . . 0.0 111.095 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.15 -9.94 59.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 173.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.46 ' HA ' ' CE ' ' A' ' 40' ' ' MET . 20.2 mt -88.44 6.75 36.09 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.611 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -136.06 12.28 3.34 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-O 121.937 0.875 . . . . 0.0 109.159 173.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.692 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 23.1 t70 -91.83 -179.82 5.42 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 114.416 -1.265 . . . . 0.0 110.614 -170.157 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.692 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.66 -26.86 62.71 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-O 121.02 0.438 . . . . 0.0 110.526 175.608 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.677 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -66.23 -30.07 70.44 Favored 'General case' 0 C--O 1.247 0.932 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 174.696 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.569 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.98 -40.85 90.51 Favored 'General case' 0 C--O 1.193 -1.884 0 CA-C-O 118.476 -0.773 . . . . 0.0 110.976 -179.004 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.2 pt-20 -61.49 -31.8 71.8 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.507 -174.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -75.68 -43.23 48.38 Favored 'General case' 0 C--O 1.262 1.76 0 CA-C-O 121.479 0.656 . . . . 0.0 110.57 176.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.677 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 17.9 mt -64.14 -47.29 80.52 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.261 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 40' ' ' MET . 27.7 m -69.37 -30.63 46.43 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.05 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.082 178.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.26 -50.42 69.54 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 175.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.565 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.1 t80 -59.68 -48.37 81.95 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.444 174.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.69 -38.39 87.65 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 120.552 -0.459 . . . . 0.0 112.085 -175.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.07 -45.81 76.2 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 123.036 0.535 . . . . 0.0 110.665 177.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -64.03 -38.14 89.98 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.485 0.66 . . . . 0.0 110.139 -177.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.489 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 50.0 t -73.1 -44.07 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.836 179.266 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -58.3 -45.63 87.62 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 177.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.76 -42.24 97.92 Favored Glycine 0 CA--C 1.503 -0.714 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.153 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.438 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 27.0 t70 -55.06 -54.37 43.93 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 123.026 0.53 . . . . 0.0 111.26 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.645 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -70.39 -30.35 67.23 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -179.611 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -62.32 -48.51 79.52 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 176.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -73.74 -24.24 59.87 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.519 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -75.03 -31.93 61.45 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-O 121.417 0.627 . . . . 0.0 110.037 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.56 167.09 12.83 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 121.683 0.754 . . . . 0.0 112.977 -175.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -118.5 11.35 12.9 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.97 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.3 p -164.76 156.22 15.27 Favored 'General case' 0 N--CA 1.421 -1.917 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.483 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.14 -28.16 63.08 Favored 'General case' 0 C--O 1.202 -1.404 0 C-N-CA 119.447 -0.901 . . . . 0.0 111.065 179.756 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -61.34 -47.79 84.26 Favored 'General case' 0 C--O 1.211 -0.925 0 O-C-N 123.66 0.6 . . . . 0.0 109.581 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 5.1 tp10 -60.93 -48.97 79.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.257 177.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -46.41 81.99 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.031 -175.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -62.66 -41.23 98.95 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 123.542 0.526 . . . . 0.0 109.742 176.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 -60.05 -57.54 12.39 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.131 0.572 . . . . 0.0 112.244 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.645 HD11 ' HB2' ' A' ' 54' ' ' MET . 3.6 pp -66.57 -32.08 73.19 Favored 'General case' 0 C--O 1.252 1.206 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -174.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.757 HD21 HD23 ' A' ' 18' ' ' LEU . 1.0 OUTLIER -75.86 -31.42 59.27 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.44 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.481 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -65.2 -34.39 78.26 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.77 175.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -68.82 -44.36 73.66 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.393 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.1 -39.08 86.65 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.174 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.482 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 7.2 tt -66.54 -44.3 90.25 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.47 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.224 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.452 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 54.4 t80 -55.36 -51.64 66.14 Favored 'General case' 0 C--O 1.255 1.386 0 C-N-CA 124.741 1.217 . . . . 0.0 111.022 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.87 -34.64 78.88 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.676 -178.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.15 -38.53 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.897 178.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.527 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 33.4 mt-30 -66.69 -41.57 87.84 Favored 'General case' 0 CA--C 1.509 -0.611 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.075 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.54 ' HA ' ' HG2' ' A' ' 80' ' ' GLU . 0.6 OUTLIER -71.7 -28.27 63.59 Favored 'General case' 0 N--CA 1.424 -1.741 0 C-N-CA 118.936 -1.106 . . . . 0.0 113.541 176.199 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -66.57 -42.3 87.26 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.594 ' O ' ' HB2' ' A' ' 83' ' ' ARG . 4.6 pp -65.83 -46.09 79.83 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.957 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 16.9 pt-20 -68.93 -35.36 76.71 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 119.246 -0.981 . . . . 0.0 111.904 -177.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.9 pt-20 -68.53 -42.08 78.98 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 120.039 -0.665 . . . . 0.0 111.168 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.613 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -70.02 -33.66 72.28 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.494 0.664 . . . . 0.0 110.761 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.613 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 26.5 ttt180 -77.56 -34.38 53.74 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.945 -172.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 59.3 ttt180 -108.05 -59.0 1.91 Allowed 'General case' 0 N--CA 1.438 -1.073 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.7 m -157.88 92.12 1.17 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -171.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.409 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 15.9 ptm180 -142.15 -21.59 0.7 Allowed 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.889 165.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.243 0.742 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 171.072 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.83 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 30.9 t -73.53 -31.7 63.81 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -70.05 -23.13 63.04 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.406 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 8.5 t -89.11 79.33 7.22 Favored 'General case' 0 N--CA 1.418 -2.026 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -74.66 -22.52 58.84 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 113.935 -1.484 . . . . 0.0 111.718 -176.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 58.58 84.24 0.11 Allowed 'General case' 0 C--O 1.24 0.579 0 CA-C-O 122.656 1.217 . . . . 0.0 112.243 -174.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 142.9 -44.88 0.94 Allowed Glycine 0 N--CA 1.416 -2.672 0 CA-C-N 112.721 -2.036 . . . . 0.0 108.671 -175.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -112.95 14.25 19.68 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -73.29 -11.86 60.65 Favored 'General case' 0 N--CA 1.483 1.194 0 O-C-N 121.41 -0.806 . . . . 0.0 110.154 179.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 25.6 p -59.01 -28.75 66.68 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.31 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 37.4 tp -56.23 -58.02 9.72 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.83 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.471 ' HA ' ' HB3' ' B' ' 115' ' ' LEU . 20.5 pt20 -76.01 -25.26 55.54 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.677 -177.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.08 -47.62 79.39 Favored 'General case' 0 C--O 1.254 1.293 0 CA-C-O 122.087 0.946 . . . . 0.0 108.968 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.52 HD21 ' HB3' ' A' ' 79' ' ' LEU . 26.3 tp -71.94 -27.34 62.73 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.41 178.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.598 HD23 ' NZ ' ' A' ' 82' ' ' LYS . 2.9 tm? -67.43 -35.93 80.22 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 172.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 47.0 m -62.7 -37.43 86.44 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 177.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.518 ' O ' ' HG ' ' B' ' 120' ' ' LEU . 13.3 m -66.58 -49.54 66.05 Favored 'General case' 0 CA--C 1.557 1.219 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.509 173.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -55.67 -36.52 67.19 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.251 1.021 . . . . 0.0 111.149 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 41.7 m -66.25 -18.3 65.27 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.671 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' B' ' 117' ' ' SER . 3.2 pp -95.57 -20.93 18.59 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.314 -0.954 . . . . 0.0 110.129 175.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 121' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 28' ' ' PRO . 32.5 t -77.33 -60.78 2.22 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.799 -177.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 58.72 -69.74 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 124.368 1.067 . . . . 0.0 110.617 -169.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 123' ' ' SER . . . . . 0.573 ' O ' ' HA ' ' A' ' 30' ' ' PRO . 42.5 m -101.05 150.56 22.78 Favored 'General case' 0 N--CA 1.427 -1.616 0 C-N-CA 124.352 1.061 . . . . 0.0 108.674 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -99.67 128.05 45.77 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-O 120.827 0.346 . . . . 0.0 110.864 -176.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -88.16 -19.21 53.83 Favored Glycine 0 N--CA 1.438 -1.193 0 C-N-CA 120.894 -0.669 . . . . 0.0 111.76 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 76.08 -157.95 49.02 Favored Glycine 0 N--CA 1.443 -0.887 0 N-CA-C 111.251 -0.739 . . . . 0.0 111.251 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 148.91 86.87 0.06 OUTLIER Glycine 0 N--CA 1.436 -1.333 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.628 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 36.5 m -69.01 122.59 19.0 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 120.795 0.331 . . . . 0.0 110.108 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -114.77 108.79 2.02 Favored Glycine 0 N--CA 1.43 -1.76 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.016 -178.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -162.45 -127.61 0.89 Allowed Glycine 0 N--CA 1.433 -1.521 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 76.81 -142.78 28.16 Favored Glycine 0 N--CA 1.431 -1.694 0 C-N-CA 120.778 -0.725 . . . . 0.0 111.407 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 11.6 p -153.99 126.48 8.05 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 -178.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 133' ' ' GLY . . . . . 0.548 ' HA3' ' HG2' ' B' ' 138' ' ' GLU . . . -85.44 -69.89 1.34 Allowed Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.029 -1.082 . . . . 0.0 111.61 178.219 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 118.19 56.73 0.28 Allowed Glycine 0 C--O 1.248 1.018 0 C-N-CA 120.046 -1.073 . . . . 0.0 112.548 176.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -145.39 -46.89 0.04 OUTLIER Glycine 0 N--CA 1.425 -2.09 0 C-N-CA 121.497 -0.382 . . . . 0.0 112.492 178.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 29.3 p -161.02 -80.29 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.419 ' O ' ' HG3' ' B' ' 141' ' ' MET . 67.6 mt -92.2 -37.02 12.94 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.383 0.611 . . . . 0.0 111.22 -174.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.548 ' HG2' ' HA3' ' B' ' 133' ' ' GLY . 0.0 OUTLIER -67.23 -12.95 61.44 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -170.274 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 37.6 t -73.72 -36.63 65.23 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.746 -178.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -135.87 70.12 1.43 Allowed 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.59 0.709 . . . . 0.0 110.841 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.512 ' HB3' ' HB ' ' B' ' 145' ' ' ILE . 63.6 mtm -103.32 -55.17 2.45 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.491 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 8.57 -73.63 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 127.651 2.381 . . . . 0.0 117.147 -174.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 7.0 p -70.56 -44.76 66.77 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-O 121.544 0.688 . . . . 0.0 111.618 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 69.7 mt -62.32 -53.63 44.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.228 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.512 ' HB ' ' HB3' ' B' ' 141' ' ' MET . 16.2 tt -64.66 -31.3 53.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.822 -176.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.419 ' O ' ' HA ' ' B' ' 150' ' ' MET . 29.6 ttt180 -63.36 -54.44 36.92 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 39.0 t -67.09 -41.75 85.8 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.222 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -79.55 -53.91 6.41 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -174.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.622 HD22 ' HD3' ' A' ' 21' ' ' LYS . 10.2 tt -98.72 -10.05 23.7 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -175.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.484 ' SD ' ' HB2' ' A' ' 76' ' ' GLN . 23.8 ttt 81.53 151.37 0.1 Allowed 'General case' 0 C--O 1.251 1.182 0 CA-C-O 121.9 0.857 . . . . 0.0 112.577 173.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -146.22 -171.6 3.76 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 -175.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.312 -1.032 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -178.064 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.034 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.5 m -108.3 129.65 62.26 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-N 117.339 0.57 . . . . 0.0 110.526 178.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -104.55 88.98 3.07 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-O 121.854 0.835 . . . . 0.0 111.873 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -138.96 106.21 5.5 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 113.861 -1.518 . . . . 0.0 108.893 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.46 -14.35 8.99 Favored Glycine 0 N--CA 1.475 1.282 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 -170.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.2 p-90 -73.02 -11.69 60.65 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 117.535 0.667 . . . . 0.0 111.835 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.45 -18.39 50.98 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 121.248 0.547 . . . . 0.0 111.691 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -75.73 -21.73 57.23 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.301 0.572 . . . . 0.0 110.448 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -101.92 14.29 32.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.353 0.597 . . . . 0.0 111.631 -174.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.429 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 4.1 p -135.11 110.63 12.54 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.229 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.12 165.72 12.1 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.151 -0.931 . . . . 0.0 113.337 -176.19 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -59.85 -36.13 76.21 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.669 -176.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -71.8 -33.21 68.37 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.03 -0.668 . . . . 0.0 111.888 -176.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.547 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -66.81 -50.52 62.37 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.51 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.3 ptm180 -67.92 -42.91 80.35 Favored 'General case' 0 N--CA 1.413 -2.279 0 CA-C-N 114.291 -1.322 . . . . 0.0 112.433 -177.282 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.1 t -63.96 -26.99 68.83 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.197 0.523 . . . . 0.0 110.277 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 8.5 t60 -65.62 -52.63 50.48 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 175.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.772 HD23 HD21 ' A' ' 68' ' ' LEU . 4.4 mp -61.39 -42.66 99.08 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.356 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 15' ' ' ARG . 51.5 t -55.92 -50.32 69.74 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 C-N-CA 124.442 1.097 . . . . 0.0 110.487 175.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -55.33 -42.63 74.06 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 123.833 0.853 . . . . 0.0 110.477 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 46.6 mttm -69.58 -36.54 76.35 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.317 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 19' ' ' VAL . 83.5 mt -57.01 -42.1 79.7 Favored 'General case' 0 CA--C 1.518 -0.268 0 O-C-N 123.286 0.366 . . . . 0.0 110.022 175.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.487 HG11 ' HE1' ' A' ' 40' ' ' MET . 55.7 t -56.88 -52.84 50.12 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.148 0 O-C-N 124.22 0.95 . . . . 0.0 110.533 171.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -54.65 -33.54 60.8 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.453 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.0 -43.95 18.84 Favored 'General case' 0 C--O 1.206 -1.195 0 CA-C-O 121.16 0.505 . . . . 0.0 111.856 177.184 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.451 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.6 tt -73.72 -31.42 31.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 O-C-N 120.952 -1.092 . . . . 0.0 110.885 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.404 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 17.9 m-85 -132.07 95.44 21.86 Favored Pre-proline 0 C--N 1.264 -3.144 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.176 -176.183 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 18.7 Cg_endo -63.89 94.14 0.19 Allowed 'Trans proline' 0 C--N 1.358 1.034 0 C-N-CA 122.219 1.946 . . . . 0.0 110.556 177.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.411 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 14.6 t -62.94 132.56 95.01 Favored Pre-proline 0 N--CA 1.426 -1.649 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.383 -175.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.542 ' HA ' ' HA3' ' B' ' 125' ' ' GLY . 29.8 Cg_endo -67.51 -33.14 29.88 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.7 2.267 . . . . 0.0 111.791 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -150.9 147.65 21.31 Favored Pre-proline 0 C--N 1.306 -1.289 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 -177.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -56.29 -17.87 22.3 Favored 'Trans proline' 0 CA--C 1.553 1.425 0 C-N-CA 122.507 2.138 . . . . 0.0 113.596 174.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.33 -6.02 59.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.696 -0.627 . . . . 0.0 112.193 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.411 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -81.84 -11.35 58.99 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 122.138 0.971 . . . . 0.0 108.8 175.053 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.463 ' O ' ' HG2' ' A' ' 40' ' ' MET . 33.8 mt -84.91 4.51 33.11 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.233 -1.348 . . . . 0.0 110.472 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -133.22 17.36 4.08 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-O 121.863 0.84 . . . . 0.0 109.856 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.584 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 37.2 t70 -92.02 177.11 6.27 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.827 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.81 -26.84 63.48 Favored 'General case' 0 C--N 1.307 -1.248 0 O-C-N 122.28 -0.262 . . . . 0.0 110.409 176.478 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.581 ' O ' HD13 ' A' ' 43' ' ' LEU . 39.8 ttm180 -60.08 -35.81 76.0 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.719 0.771 . . . . 0.0 109.558 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.61 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.8 tpp -57.83 -32.27 67.44 Favored 'General case' 0 C--O 1.2 -1.509 0 CA-C-N 114.603 -1.18 . . . . 0.0 112.228 178.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 13.5 pt-20 -64.28 -32.37 73.93 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 118.551 -1.26 . . . . 0.0 110.299 -178.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -72.6 -45.28 59.84 Favored 'General case' 0 C--O 1.253 1.27 0 CA-C-O 122.277 1.037 . . . . 0.0 109.139 176.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.581 HD13 ' O ' ' A' ' 39' ' ' ARG . 3.0 mp -55.7 -56.33 21.76 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 113.551 -1.659 . . . . 0.0 110.165 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.61 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 2.7 p -70.28 -27.55 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.858 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.176 -176.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.6 -49.36 76.67 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 176.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.526 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.1 t80 -62.21 -45.55 92.85 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.083 175.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.22 -45.99 83.34 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.915 -177.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -63.88 -43.84 94.84 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 124.055 0.942 . . . . 0.0 112.857 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 59.1 pttt -64.09 -41.05 97.44 Favored 'General case' 0 C--O 1.251 1.163 0 CA-C-O 121.582 0.706 . . . . 0.0 110.175 -177.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.479 HG21 ' CE2' ' A' ' 46' ' ' TYR . 55.9 t -73.1 -45.04 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.163 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.415 ' HG3' HG23 ' A' ' 19' ' ' VAL . 14.9 tm-20 -58.06 -45.25 87.37 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 177.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.25 -43.15 93.7 Favored Glycine 0 N--CA 1.438 -1.203 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.111 178.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -58.53 -54.12 50.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.661 0.267 . . . . 0.0 111.495 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.432 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -65.77 -31.43 72.4 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 179.665 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -65.05 -38.74 91.83 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -82.09 -23.25 35.85 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 121.747 -0.596 . . . . 0.0 112.063 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -80.22 -40.95 26.1 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 123.047 0.539 . . . . 0.0 111.473 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.17 161.09 29.1 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -106.12 7.4 31.68 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.829 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.5 p -159.11 157.9 31.88 Favored 'General case' 0 CA--C 1.477 -1.849 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.437 ' HG2' HD11 ' B' ' 137' ' ' LEU . 0.2 OUTLIER -72.48 -24.43 61.18 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.066 -1.053 . . . . 0.0 109.614 178.184 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -67.57 -47.48 69.66 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 115.088 -0.96 . . . . 0.0 108.499 177.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -60.36 -46.59 89.39 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.496 175.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -46.4 85.87 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 123.319 0.387 . . . . 0.0 110.631 -177.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.402 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 2.9 t80 -62.0 -44.67 96.24 Favored 'General case' 0 C--O 1.216 -0.707 0 O-C-N 123.643 0.59 . . . . 0.0 110.679 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -67.7 -43.13 80.85 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.432 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.3 pp -71.69 -35.18 70.17 Favored 'General case' 0 C--O 1.25 1.079 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.123 -177.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.772 HD21 HD23 ' A' ' 18' ' ' LEU . 1.3 pp -72.26 -33.68 67.67 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.551 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.51 -39.63 94.93 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.03 176.096 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -62.15 -49.47 75.73 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.433 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -34.55 72.51 Favored 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.042 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.56 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 4.9 tt -70.88 -45.85 71.13 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.563 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -55.15 -50.75 68.48 Favored 'General case' 0 C--O 1.282 2.798 0 C-N-CA 124.665 1.186 . . . . 0.0 110.887 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -62.98 -39.5 94.91 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.629 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.453 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.3 mp -62.44 -39.92 86.14 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.981 0 O-C-N 123.356 0.41 . . . . 0.0 111.861 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.631 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 22.1 mm-40 -57.75 -49.67 75.81 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 121.87 0.843 . . . . 0.0 109.637 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.496 ' H ' ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -70.45 -38.21 74.44 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.661 0.985 . . . . 0.0 113.661 178.076 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.33 -45.53 91.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 3.7 pp -64.25 -42.82 96.33 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.489 -177.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.462 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 4.7 mm-40 -68.9 -41.44 78.25 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -70.47 -35.03 73.06 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 119.464 -0.894 . . . . 0.0 111.438 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.53 -29.87 62.74 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.549 0.69 . . . . 0.0 109.788 178.009 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 4.9 tmm_? -76.96 -32.1 57.05 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.01 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.505 ' O ' ' HB2' ' A' ' 85' ' ' SER . 25.8 tpt180 -75.09 -59.29 2.81 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.364 174.083 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.505 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 20.4 t 158.1 111.81 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.302 1.441 . . . . 0.0 108.171 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.503 ' HG3' HD22 ' A' ' 87' ' ' LEU . 12.3 ptm180 -124.33 -19.97 5.35 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.776 172.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.503 HD22 ' HG3' ' A' ' 86' ' ' ARG . 4.3 mm? . . . . . 0 C--O 1.247 0.942 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 174.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 110.453 -1.059 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 17.3 t -114.87 104.62 12.11 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 117.493 0.647 . . . . 0.0 109.434 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 26.0 mmt -110.88 -22.94 11.28 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.203 0.525 . . . . 0.0 110.832 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 47.0 m -102.67 15.5 29.11 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.031 -179.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -159.38 129.97 5.85 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -154.11 -165.21 2.04 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.016 177.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.47 92.05 0.09 OUTLIER Glycine 0 C--N 1.308 -0.986 0 O-C-N 123.149 0.28 . . . . 0.0 113.775 -174.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 55.0 t30 65.03 40.59 5.05 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-O 121.844 0.83 . . . . 0.0 108.927 174.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -60.98 -24.23 65.96 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 176.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 3.4 m -55.08 -32.89 62.32 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 126.035 1.734 . . . . 0.0 111.486 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 59.8 tp -60.57 -54.98 38.84 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.035 0.445 . . . . 0.0 110.745 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -75.64 -27.45 58.4 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.591 -0.443 . . . . 0.0 111.113 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -63.41 -48.79 76.38 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 121.537 0.684 . . . . 0.0 109.728 175.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.526 HD21 ' HB3' ' A' ' 79' ' ' LEU . 31.8 tp -69.13 -27.97 66.04 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.285 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.19 -40.03 82.32 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 174.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 43.6 m -63.81 -39.53 94.46 Favored 'General case' 0 CA--C 1.552 1.021 0 CA-C-O 121.353 0.597 . . . . 0.0 109.402 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.1 t -68.44 -42.49 78.76 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.398 177.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -56.0 -45.85 78.9 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.898 1.679 . . . . 0.0 111.278 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 28.5 m -62.01 -28.3 69.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.195 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 7.1 tt -68.55 -37.46 79.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 23.8 m -76.23 -10.13 59.17 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.006 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 80.54 -39.57 0.16 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.022 1.729 . . . . 0.0 114.143 176.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 32.6 t -161.15 -77.58 0.05 Allowed 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.143 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -169.88 -177.87 2.76 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -172.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 125' ' ' GLY . . . . . 0.542 ' HA3' ' HA ' ' A' ' 30' ' ' PRO . . . -171.01 -114.15 0.31 Allowed Glycine 0 N--CA 1.434 -1.487 0 C-N-CA 120.245 -0.979 . . . . 0.0 112.527 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 163.79 163.1 15.88 Favored Glycine 0 N--CA 1.431 -1.638 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -178.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 157.16 35.57 0.02 OUTLIER Glycine 0 C--N 1.306 -1.129 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 34.0 m -68.95 153.94 42.92 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 122.784 0.434 . . . . 0.0 111.122 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 168.07 -169.32 41.34 Favored Glycine 0 N--CA 1.436 -1.329 0 C-N-CA 120.831 -0.7 . . . . 0.0 111.509 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -135.59 -104.92 0.78 Allowed Glycine 0 N--CA 1.433 -1.506 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 117.24 49.52 0.4 Allowed Glycine 0 C--N 1.305 -1.156 0 C-N-CA 121.189 -0.529 . . . . 0.0 112.686 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 132' ' ' SER . . . . . 0.404 ' HB3' ' O ' ' B' ' 139' ' ' CYS . 65.2 m -67.32 134.5 51.66 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 178.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 133' ' ' GLY . . . . . 0.446 ' O ' ' HA ' ' B' ' 139' ' ' CYS . . . -121.74 -133.75 4.39 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -178.171 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -133.25 65.09 0.59 Allowed Glycine 0 C--N 1.305 -1.177 0 C-N-CA 120.157 -1.02 . . . . 0.0 112.312 -178.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -137.37 -156.88 7.41 Favored Glycine 0 C--N 1.311 -0.837 0 C-N-CA 120.428 -0.891 . . . . 0.0 112.362 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 9.1 m -46.06 -84.03 0.01 OUTLIER 'General case' 0 CA--C 1.566 1.571 0 C-N-CA 125.464 1.506 . . . . 0.0 114.474 -175.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.437 HD11 ' HG2' ' A' ' 61' ' ' ARG . 87.7 mt -97.43 -24.84 15.43 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' B' ' 138' ' ' GLU . 9.4 pt-20 -62.11 -12.03 17.33 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 127.187 2.195 . . . . 0.0 114.182 -176.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 139' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' B' ' 133' ' ' GLY . 6.1 p -57.24 -59.54 4.96 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -139.67 96.86 3.15 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.514 ' HB3' ' HB ' ' B' ' 145' ' ' ILE . 69.3 mtp -97.76 -47.55 5.55 Favored 'General case' 0 C--N 1.292 -1.917 0 C-N-CA 119.486 -0.885 . . . . 0.0 110.423 -178.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 25.64 -84.13 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 127.853 2.461 . . . . 0.0 115.502 176.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.1 p -72.86 -47.1 48.96 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 114.55 -1.204 . . . . 0.0 111.216 -175.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 65.3 mt -63.79 -41.91 94.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.767 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.514 ' HB ' ' HB3' ' B' ' 141' ' ' MET . 9.5 tp -66.19 -41.32 89.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.097 0 C-N-CA 119.617 -0.833 . . . . 0.0 110.693 -178.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -66.17 -57.08 8.4 Favored 'General case' 0 N--CA 1.436 -1.128 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.133 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 43.4 t -55.2 -53.96 49.41 Favored 'General case' 0 C--O 1.249 1.049 0 C-N-CA 123.757 0.823 . . . . 0.0 113.133 -176.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.444 ' O ' ' HB1' ' A' ' 69' ' ' ALA . 5.5 mm-40 -81.84 -42.25 19.89 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -172.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.495 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 1.5 tm? -81.19 -53.32 6.47 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.469 -0.493 . . . . 0.0 110.358 -173.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.419 ' HG3' HD12 ' B' ' 149' ' ' LEU . 4.9 ppp? -177.16 117.46 0.1 Allowed 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 121.436 0.636 . . . . 0.0 110.614 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -80.82 -41.3 23.53 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 175.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.401 -2.912 0 N-CA-C 102.047 -3.316 . . . . 0.0 102.047 178.656 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.518 0 N-CA-C 111.772 -0.531 . . . . 0.0 111.772 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.2 t -86.13 116.77 29.6 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.403 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -104.56 140.64 37.7 Favored 'General case' 0 N--CA 1.419 -1.997 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -177.485 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.503 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.6 ptpt -146.31 104.03 3.75 Favored 'General case' 0 C--N 1.266 -3.054 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.647 -178.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.414 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -74.02 -0.68 57.17 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 114.589 -1.187 . . . . 0.0 113.702 -175.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.503 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 52.2 p-90 -72.67 -7.74 51.86 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 117.57 0.685 . . . . 0.0 111.584 177.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -65.99 -9.61 31.84 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 9.7 pt-20 -88.13 -8.64 55.12 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.272 0.558 . . . . 0.0 110.027 174.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -94.98 9.89 37.67 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.533 0.682 . . . . 0.0 109.867 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.421 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.6 p -141.79 155.17 19.8 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.2 m -123.69 160.59 26.88 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -57.62 -36.1 71.34 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 120.903 0.382 . . . . 0.0 110.226 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 4.0 m-20 -63.68 -33.69 76.19 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.521 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.17 -51.13 19.01 Favored 'General case' 0 CA--C 1.498 -1.055 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 -177.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.517 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -64.81 -44.18 90.75 Favored 'General case' 0 N--CA 1.423 -1.802 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.976 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.8 t -66.29 -29.17 69.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.438 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 18.2 t60 -65.18 -44.69 87.64 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.727 HD23 HD21 ' A' ' 68' ' ' LEU . 3.7 mp -66.6 -39.64 88.48 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.338 177.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 15' ' ' ARG . 55.0 t -57.45 -51.9 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.842 0.857 . . . . 0.0 110.3 175.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -55.98 -45.78 78.86 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.314 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -65.84 -40.22 91.55 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.245 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 19' ' ' VAL . 28.7 mt -51.26 -50.29 59.52 Favored 'General case' 0 CA--C 1.498 -1.048 0 O-C-N 123.676 0.61 . . . . 0.0 109.543 174.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.424 HG13 ' HB3' ' A' ' 43' ' ' LEU . 41.9 t -53.92 -51.69 42.92 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.497 0 O-C-N 124.468 1.105 . . . . 0.0 110.528 175.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -55.77 -35.41 66.21 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -176.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.486 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -81.44 -45.58 15.84 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 177.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.503 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.72 -25.49 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 122.044 0.926 . . . . 0.0 110.565 -174.682 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.587 ' CG ' HD22 ' A' ' 43' ' ' LEU . 57.6 m-85 -131.44 98.07 18.77 Favored Pre-proline 0 C--N 1.278 -2.514 0 CA-C-N 115.289 -0.869 . . . . 0.0 108.732 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -49.51 133.63 31.83 Favored 'Trans proline' 0 CA--C 1.48 -2.183 0 C-N-CA 122.394 2.063 . . . . 0.0 111.209 177.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.1 m -91.28 116.8 67.17 Favored Pre-proline 1 N--CA 1.369 -4.505 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.374 -174.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -79.92 -30.42 2.27 Favored 'Trans proline' 0 C--N 1.323 -0.78 0 C-N-CA 122.088 1.858 . . . . 0.0 111.255 176.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -147.84 147.43 27.03 Favored Pre-proline 0 CA--C 1.488 -1.431 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -69.2 -12.02 32.97 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 121.231 1.287 . . . . 0.0 110.283 172.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.32 -13.71 45.75 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.089 175.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.717 ' HA ' ' OD2' ' A' ' 37' ' ' ASP . . . -72.07 -15.17 62.01 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 122.18 0.991 . . . . 0.0 109.478 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.9 mt -85.36 7.34 22.79 Favored 'General case' 0 N--CA 1.426 -1.629 0 CA-C-N 113.592 -1.64 . . . . 0.0 109.403 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -132.89 0.44 3.5 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 118.984 -1.087 . . . . 0.0 109.914 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.717 ' OD2' ' HA ' ' A' ' 34' ' ' ALA . 48.5 m-20 -72.88 176.86 5.28 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.157 -175.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.645 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -65.35 -21.81 66.74 Favored 'General case' 0 C--O 1.203 -1.342 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 170.637 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.636 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 41.0 ttp180 -65.04 -29.52 70.43 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.19 175.443 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.589 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.02 -39.57 82.31 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-O 118.763 -0.636 . . . . 0.0 110.209 -179.503 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.8 pt-20 -62.81 -28.37 69.96 Favored 'General case' 0 C--O 1.205 -1.257 0 O-C-N 123.238 0.336 . . . . 0.0 110.946 -176.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -76.17 -46.18 29.78 Favored 'General case' 0 C--O 1.265 1.911 0 CA-C-O 121.696 0.76 . . . . 0.0 110.008 177.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 18.3 mt -63.81 -49.57 72.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.204 -178.173 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 40' ' ' MET . 34.0 m -68.52 -33.17 58.57 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.294 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.383 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.21 -46.97 75.92 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 118.325 0.511 . . . . 0.0 109.991 175.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.543 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 6.6 t80 -63.1 -48.64 77.7 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.645 174.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.35 -43.52 88.35 Favored 'General case' 0 C--O 1.201 -1.474 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.356 -176.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -66.19 -40.77 90.65 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 124.117 0.967 . . . . 0.0 111.827 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 53.2 pttt -66.71 -40.71 88.55 Favored 'General case' 0 C--O 1.251 1.151 0 CA-C-O 121.497 0.665 . . . . 0.0 109.945 -178.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.412 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 79.3 t -71.63 -49.23 47.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.605 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.3 tm-20 -57.93 -47.67 82.18 Favored 'General case' 0 CA--C 1.51 -0.594 0 C-N-CA 123.836 0.854 . . . . 0.0 109.17 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.77 -38.72 92.61 Favored Glycine 0 N--CA 1.428 -1.859 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.445 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -64.11 -51.78 62.34 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 111.543 0.201 . . . . 0.0 111.543 178.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.437 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -64.28 -32.38 73.96 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 178.025 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -64.78 -41.62 95.7 Favored 'General case' 0 C--O 1.201 -1.476 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -80.73 -16.78 53.0 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.622 -0.674 . . . . 0.0 112.097 177.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.3 t -82.78 -52.99 6.25 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 122.536 0.334 . . . . 0.0 111.433 -178.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.17 161.66 13.18 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -175.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -104.73 6.28 34.04 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.316 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.0 p -162.42 156.22 20.93 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 174.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -67.76 -31.15 70.84 Favored 'General case' 0 C--O 1.201 -1.499 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.458 -178.787 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -65.21 -47.22 77.64 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.303 177.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -58.26 -45.16 88.34 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 111.417 0.155 . . . . 0.0 111.417 175.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -44.14 92.21 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.513 -178.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -62.46 -45.59 92.35 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.295 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.529 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 34.0 m170 -61.1 -53.97 50.47 Favored 'General case' 0 C--O 1.215 -0.741 0 O-C-N 123.274 0.359 . . . . 0.0 111.634 -178.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.437 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.4 pp -64.33 -36.73 85.09 Favored 'General case' 0 C--O 1.256 1.417 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -175.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.727 HD21 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -74.67 -33.86 62.57 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.523 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.46 -32.76 74.3 Favored 'General case' 0 C--O 1.205 -1.275 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.343 175.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 22.1 mt-10 -72.4 -41.37 66.36 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.276 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -65.82 -39.03 90.45 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.403 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.523 HG22 ' HA ' ' A' ' 69' ' ' ALA . 8.7 tt -68.24 -42.99 85.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.297 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.491 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 39.1 t80 -58.19 -52.48 65.38 Favored 'General case' 0 C--O 1.259 1.578 0 C-N-CA 124.427 1.091 . . . . 0.0 111.348 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -64.4 -33.34 75.63 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.464 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -68.92 -37.68 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.867 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.167 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.509 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 11.5 mt-30 -66.6 -41.48 88.38 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.629 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.511 ' HB3' ' HE2' ' A' ' 77' ' ' LYS . 10.6 ptpt -75.23 -27.09 59.37 Favored 'General case' 0 N--CA 1.424 -1.763 0 C-N-CA 118.982 -1.087 . . . . 0.0 112.759 176.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.518 ' OE2' ' HG2' ' A' ' 82' ' ' LYS . 5.5 tm-20 -62.56 -48.89 77.51 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 175.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.597 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -63.7 -39.67 94.89 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.836 178.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -55.56 -53.6 54.4 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 123.466 0.479 . . . . 0.0 111.289 176.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -68.92 -47.03 66.78 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 120.15 -0.62 . . . . 0.0 112.418 -177.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.541 ' HA ' ' HG2' ' A' ' 86' ' ' ARG 0.254 0.0 OUTLIER -74.09 -38.73 63.79 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -176.337 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 7.6 mmm180 -78.03 -26.08 48.23 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.408 ' HD2' ' HA ' ' A' ' 84' ' ' ARG . 12.9 tpt180 -98.74 -58.38 1.96 Allowed 'General case' 0 N--CA 1.427 -1.617 0 C-N-CA 117.689 -1.604 . . . . 0.0 112.153 -179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.5 m -161.75 96.26 1.02 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -173.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.541 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 4.9 ptt180 -158.58 -34.48 0.07 Allowed 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 120.971 0.415 . . . . 0.0 110.274 168.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 C--O 1.242 0.71 0 O-C-N 122.28 -0.262 . . . . 0.0 110.627 -176.778 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 101' ' ' GLY . . . . . 0.463 ' CA ' ' HB2' ' B' ' 113' ' ' ASP . . . . . . . . 0 CA--C 1.493 -1.296 0 N-CA-C 111.209 -0.757 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 8.9 m -81.02 24.74 0.49 Allowed 'General case' 0 C--N 1.308 -1.201 0 CA-C-O 121.372 0.606 . . . . 0.0 110.104 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' MET . . . . . 0.491 ' HB2' HE22 ' B' ' 112' ' ' GLN . 82.9 mtp -78.48 -30.6 47.42 Favored 'General case' 0 CA--C 1.506 -0.712 0 C-N-CA 123.587 0.755 . . . . 0.0 110.634 -176.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 23.1 t -147.66 -59.26 0.26 Allowed 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -178.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -75.32 106.02 6.63 Favored 'General case' 0 C--O 1.215 -0.741 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 176.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -97.19 1.23 49.54 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.628 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -108.02 -64.42 0.58 Allowed Glycine 0 N--CA 1.432 -1.607 0 N-CA-C 109.384 -1.486 . . . . 0.0 109.384 174.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -93.74 52.64 1.71 Allowed 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.66 0.743 . . . . 0.0 109.343 178.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -59.65 -27.89 66.75 Favored 'General case' 0 C--O 1.249 1.031 0 CA-C-N 114.666 -1.152 . . . . 0.0 112.215 -178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 14.6 t -66.78 -25.25 66.38 Favored 'General case' 0 N--CA 1.421 -1.906 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.221 -179.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 43.3 tp -56.99 -59.78 4.55 Favored 'General case' 0 C--O 1.261 1.684 0 CA-C-N 118.192 0.451 . . . . 0.0 110.51 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.491 HE22 ' HB2' ' B' ' 103' ' ' MET . 20.4 pt20 -75.65 -35.51 60.41 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.895 -176.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 113' ' ' ASP . . . . . 0.463 ' HB2' ' CA ' ' B' ' 101' ' ' GLY . 22.7 t70 -67.98 -45.44 74.15 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.231 0.539 . . . . 0.0 110.845 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.597 HD21 ' HB3' ' A' ' 79' ' ' LEU . 52.9 tp -69.52 -32.04 70.64 Favored 'General case' 0 C--O 1.201 -1.454 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.038 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.2 tp -67.83 -36.71 80.83 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.192 177.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 88.0 m -64.92 -46.73 80.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.097 176.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.5 m -64.12 -38.08 89.76 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.616 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -62.34 -46.86 86.78 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 123.746 0.818 . . . . 0.0 111.851 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 15.9 t -61.05 -22.7 64.83 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.273 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 8.3 tt -65.32 -44.25 88.42 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 45.4 m -77.16 -45.9 25.2 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.271 176.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 46.9 t60 71.89 -39.2 0.44 Allowed 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 126.268 1.827 . . . . 0.0 113.8 177.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 9.5 p -81.49 -171.94 3.56 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -88.21 176.66 7.15 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -177.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -89.46 118.38 5.2 Favored Glycine 0 N--CA 1.441 -0.992 0 N-CA-C 114.562 0.585 . . . . 0.0 114.562 -172.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -142.12 115.33 0.96 Allowed Glycine 0 C--N 1.294 -1.773 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 175.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -167.42 -163.85 22.04 Favored Glycine 0 N--CA 1.442 -0.963 0 C-N-CA 120.208 -0.996 . . . . 0.0 111.99 -178.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 16.8 m -78.9 -178.08 5.86 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 123.975 0.91 . . . . 0.0 110.597 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -162.64 -49.96 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 119.729 -1.224 . . . . 0.0 113.935 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -85.74 -147.09 9.53 Favored Glycine 0 C--O 1.241 0.588 0 C-N-CA 121.425 -0.417 . . . . 0.0 113.299 -176.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 104.48 158.43 23.84 Favored Glycine 0 N--CA 1.441 -0.984 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 32.2 p -148.33 -175.27 4.85 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 117.027 0.414 . . . . 0.0 109.949 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -138.14 -146.88 5.11 Favored Glycine 0 C--N 1.309 -0.951 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 177.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -162.19 -1.67 0.06 OUTLIER Glycine 0 C--N 1.31 -0.899 0 C-N-CA 119.557 -1.306 . . . . 0.0 113.848 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -80.86 -57.69 2.81 Favored Glycine 0 N--CA 1.436 -1.36 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.959 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 58.6 p -120.74 -97.05 0.46 Allowed 'General case' 0 CA--C 1.557 1.229 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 -173.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.4 HD11 ' HG2' ' A' ' 61' ' ' ARG . 24.7 mt -86.5 -29.34 22.81 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 122.905 1.336 . . . . 0.0 108.621 -175.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.555 ' HA ' ' SD ' ' B' ' 141' ' ' MET . 7.8 pt-20 -57.66 -13.52 4.11 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 128.975 2.91 . . . . 0.0 116.221 -173.179 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 54.2 m -51.59 -57.03 10.27 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 118.474 0.579 . . . . 0.0 112.47 -174.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -149.12 77.17 1.35 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 123.176 1.465 . . . . 0.0 108.899 175.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.555 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 24.9 ptt? -104.35 -16.99 14.97 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 113.857 -1.519 . . . . 0.0 113.089 -176.006 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -28.51 -61.14 0.12 Allowed 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 126.543 1.937 . . . . 0.0 116.162 -172.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 18.5 m -68.04 -35.72 78.72 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.105 0.478 . . . . 0.0 111.48 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 62.1 mt -72.16 -45.79 60.9 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.891 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.601 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 18.0 tt -68.26 -31.57 52.09 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.4 -178.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 49.3 ttp180 -64.86 -54.75 26.07 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 33.1 t -59.24 -50.15 75.11 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.787 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -81.27 -42.69 20.28 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -175.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.601 ' HB3' ' O ' ' B' ' 145' ' ' ILE . 4.0 tt -80.6 -25.55 38.4 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -172.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . 0.28 0.0 OUTLIER -150.16 177.58 9.78 Favored 'General case' 0 N--CA 1.437 -1.122 0 C-N-CA 118.131 -1.428 . . . . 0.0 113.485 177.329 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -103.57 114.69 29.15 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -173.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.522 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 -179.882 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.38 0 N-CA-C 112.165 -0.374 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.1 t -74.71 117.45 18.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.488 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.512 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -89.91 101.01 13.72 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.106 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 14.6 ptpt -109.78 93.74 4.66 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.669 -175.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.2 -12.26 16.02 Favored Glycine 0 N--CA 1.465 0.612 0 N-CA-C 116.075 1.19 . . . . 0.0 116.075 -173.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.471 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 57.3 p-90 -64.06 -17.07 63.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.542 0.671 . . . . 0.0 111.035 178.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.471 ' HA ' HG12 ' A' ' 10' ' ' VAL . 1.4 p-80 -63.33 -10.39 16.2 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.7 -30.45 59.32 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.349 0.595 . . . . 0.0 109.88 175.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -93.11 20.41 6.87 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.524 -174.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.471 HG12 ' HA ' ' A' ' 7' ' ' HIS . 7.7 p -132.98 110.19 15.1 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -75.89 153.07 36.98 Favored 'General case' 0 C--N 1.294 -1.839 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.916 -173.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -60.63 -38.84 86.1 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 174.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.513 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 3.5 m-20 -56.91 -39.14 73.89 Favored 'General case' 0 C--O 1.214 -0.763 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.629 174.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.584 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -72.42 -52.35 16.33 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -173.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.6 ptm180 -66.15 -43.37 87.21 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-N 114.944 -1.025 . . . . 0.0 113.293 -176.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.2 t -67.11 -28.66 68.34 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 14.9 t60 -65.71 -44.12 87.04 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 176.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.698 HD23 HD21 ' A' ' 68' ' ' LEU . 4.1 mp -65.26 -41.41 94.27 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.888 176.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 15' ' ' ARG . 67.6 t -57.21 -52.42 56.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.665 0.786 . . . . 0.0 110.169 176.093 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.435 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 20.5 t-80 -54.93 -43.79 73.65 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.494 177.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.476 ' HD3' ' HG ' ' B' ' 149' ' ' LEU . 36.2 mttp -66.1 -37.95 87.02 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.375 177.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 19' ' ' VAL . 74.2 mt -55.67 -43.08 75.99 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 175.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.482 ' HA ' HG22 ' A' ' 26' ' ' ILE . 53.6 t -57.25 -52.65 53.84 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.628 0 O-C-N 124.155 0.91 . . . . 0.0 110.411 173.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -59.05 -29.15 67.09 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.71 -45.31 15.88 Favored 'General case' 0 C--O 1.207 -1.133 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.769 174.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.482 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.7 tt -69.78 -33.75 57.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-O 122.07 0.938 . . . . 0.0 110.233 -177.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -126.39 92.26 45.77 Favored Pre-proline 0 N--CA 1.4 -2.971 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -57.7 102.17 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 121.849 1.7 . . . . 0.0 107.955 171.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 t -73.92 128.27 86.88 Favored Pre-proline 0 N--CA 1.408 -2.568 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.637 -172.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -72.65 -28.83 13.66 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.417 2.078 . . . . 0.0 111.438 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -151.01 147.12 20.04 Favored Pre-proline 0 CA--C 1.498 -1.033 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -177.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.41 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 9.9 Cg_endo -56.93 -19.66 33.03 Favored 'Trans proline' 0 CA--C 1.549 1.274 0 C-N-CA 122.359 2.039 . . . . 0.0 114.171 175.053 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.38 -19.97 59.24 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 121.406 -0.809 . . . . 0.0 112.005 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.68 -7.56 50.99 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.383 0.611 . . . . 0.0 110.421 178.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.462 ' O ' ' HG2' ' A' ' 40' ' ' MET . 23.6 mt -93.48 0.31 56.68 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.689 -178.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -133.72 19.77 3.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.243 0.544 . . . . 0.0 111.979 -177.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.548 ' O ' ' HB3' ' A' ' 40' ' ' MET . 38.0 t70 -92.12 176.69 6.4 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.734 ' HD2' ' N ' ' A' ' 39' ' ' ARG . 5.4 ppt_? -61.54 -26.1 67.72 Favored 'General case' 0 C--N 1.282 -2.358 0 CA-C-O 121.922 0.868 . . . . 0.0 108.934 172.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.734 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 40.6 ttm180 -63.52 -29.41 70.68 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-O 122.145 0.974 . . . . 0.0 109.109 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.726 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.7 tpp -65.13 -34.64 78.89 Favored 'General case' 0 C--O 1.192 -1.95 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.312 -178.355 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.631 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.1 pt-20 -63.64 -32.89 74.51 Favored 'General case' 0 C--O 1.189 -2.081 0 C-N-CA 119.396 -0.922 . . . . 0.0 109.445 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -68.99 -49.85 54.21 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 121.589 0.709 . . . . 0.0 110.045 176.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 67.2 mt -63.7 -48.07 78.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.6 -176.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.726 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.4 p -73.42 -27.88 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.885 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.209 -178.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.56 93.94 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 177.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.539 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.1 t80 -60.73 -46.36 90.74 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.942 174.093 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.23 -40.17 93.01 Favored 'General case' 0 C--O 1.202 -1.443 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.956 -177.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -68.38 -43.72 76.73 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 123.312 0.645 . . . . 0.0 111.306 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.3 pttp -65.74 -38.18 88.42 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 121.118 0.485 . . . . 0.0 109.918 -177.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 41.3 t -70.76 -49.66 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.268 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.401 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -56.04 -44.67 79.0 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.49 -37.97 95.6 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.62 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -59.42 -54.25 48.81 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.445 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -67.67 -34.22 76.5 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.93 -49.85 75.79 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -77.33 -17.68 58.08 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 28.3 t -87.42 -30.85 20.4 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 120.825 0.345 . . . . 0.0 110.929 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.29 159.51 23.13 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 121.246 0.546 . . . . 0.0 111.633 -177.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -108.59 8.48 27.15 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-O 121.717 0.77 . . . . 0.0 110.4 -177.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 83.1 p -160.71 160.71 31.78 Favored 'General case' 0 N--CA 1.417 -2.101 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 173.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.426 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -72.3 -26.76 62.08 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.047 176.677 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -65.48 -47.82 74.77 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -62.83 -46.22 88.94 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.163 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.404 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.64 -48.09 76.09 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.845 -176.419 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -61.38 -45.36 94.67 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 123.796 0.685 . . . . 0.0 110.304 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.543 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 10.7 t60 -67.95 -49.86 59.3 Favored 'General case' 0 C--O 1.203 -1.372 0 CA-C-O 119.23 -0.414 . . . . 0.0 111.752 -176.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.445 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.1 pp -64.55 -35.37 80.76 Favored 'General case' 0 C--O 1.271 2.219 0 CA-C-N 118.517 0.599 . . . . 0.0 111.662 -177.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.698 HD21 HD23 ' A' ' 18' ' ' LEU . 1.3 pp -70.1 -38.55 75.67 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.548 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.75 -35.74 82.06 Favored 'General case' 0 C--O 1.2 -1.508 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.561 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 16.0 mt-10 -67.76 -43.78 79.04 Favored 'General case' 0 C--N 1.312 -1.039 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.684 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -38.93 74.76 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 118.663 -1.215 . . . . 0.0 111.732 -179.034 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.548 HG22 ' HA ' ' A' ' 69' ' ' ALA . 9.6 tt -65.62 -40.41 87.92 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 C-N-CA 120.564 -0.455 . . . . 0.0 110.112 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.493 ' CZ ' ' HE3' ' A' ' 77' ' ' LYS . 36.6 t80 -57.31 -54.5 46.15 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 124.682 1.193 . . . . 0.0 111.121 179.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.473 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.5 ptpt -66.44 -32.34 73.64 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.083 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.78 -36.92 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.809 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.154 177.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.566 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 19.6 mt-30 -67.44 -47.75 69.26 Favored 'General case' 0 CA--C 1.498 -1.056 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.635 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.505 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -69.45 -28.12 65.83 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.404 -0.919 . . . . 0.0 112.627 177.505 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.6 tp10 -65.16 -47.85 75.59 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -65.41 -36.07 82.82 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.533 -178.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.98 -47.29 78.08 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.351 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.37 -33.37 65.01 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 119.49 -0.884 . . . . 0.0 111.773 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.553 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -64.58 -36.17 83.37 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.794 178.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.417 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 16.2 tpp180 -77.66 -36.47 51.38 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.227 178.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 8.5 tpp180 -87.54 -59.68 2.18 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 119.648 -0.821 . . . . 0.0 112.955 -175.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.9 p -178.95 81.99 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -110.22 -25.61 10.06 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 171.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.7 mt . . . . . 0 C--O 1.245 0.834 0 CA-C-N 114.227 -1.352 . . . . 0.0 109.061 175.947 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.232 0 N-CA-C 111.435 -0.666 . . . . 0.0 111.435 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 16.7 m -77.71 109.7 11.92 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 49.4 tpp -132.53 -31.78 1.36 Allowed 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.588 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 14.1 t 49.79 44.86 25.05 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 124.152 0.981 . . . . 0.0 111.389 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 60.0 t60 -127.43 -26.82 2.98 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -174.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 67.23 -164.75 0.22 Allowed 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -172.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.41 -58.64 4.86 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 -176.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -118.24 34.58 5.11 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 123.753 0.821 . . . . 0.0 110.235 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -62.33 -27.2 68.88 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.389 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 6.9 m -64.02 -39.47 94.17 Favored 'General case' 0 N--CA 1.421 -1.917 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.683 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 60.9 tp -68.41 -33.43 74.21 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.32 -0.4 . . . . 0.0 109.956 178.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -64.71 -53.02 53.91 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.444 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -60.8 -39.3 88.39 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.181 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.558 HD21 ' HB3' ' A' ' 79' ' ' LEU . 62.4 tp -62.71 -44.62 95.77 Favored 'General case' 0 C--O 1.203 -1.389 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.618 177.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 60.8 tp -63.57 -38.82 92.57 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 26.4 m -65.19 -40.15 93.84 Favored 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.983 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.3 t -77.53 -25.58 50.34 Favored 'General case' 0 CA--C 1.561 1.389 0 CA-C-O 121.28 0.562 . . . . 0.0 110.204 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -69.09 -37.75 78.59 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 121.951 0.882 . . . . 0.0 109.163 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 19.1 p -76.25 -11.32 59.89 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.257 175.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 3.9 tt -85.08 -29.9 24.51 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 43.0 m -67.5 -38.32 84.14 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.58 175.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 62.5 m80 72.98 -45.37 0.62 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 125.163 1.385 . . . . 0.0 112.641 178.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 24.6 m -122.77 139.2 54.25 Favored 'General case' 0 N--CA 1.421 -1.91 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -76.51 151.57 36.36 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -145.9 -84.32 0.06 OUTLIER Glycine 0 C--N 1.298 -1.536 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 170.42 162.58 23.0 Favored Glycine 0 N--CA 1.427 -1.947 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.408 176.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -113.38 38.11 3.34 Favored Glycine 0 N--CA 1.432 -1.61 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 177.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 2.3 p -80.28 132.68 35.87 Favored 'General case' 0 N--CA 1.425 -1.694 0 C-N-CA 123.671 0.789 . . . . 0.0 111.394 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 176.33 154.23 11.46 Favored Glycine 0 N--CA 1.424 -2.138 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 167.72 -158.07 30.72 Favored Glycine 0 C--N 1.298 -1.554 0 N-CA-C 109.225 -1.55 . . . . 0.0 109.225 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 126.65 32.23 0.72 Allowed Glycine 0 C--N 1.308 -0.977 0 C-N-CA 119.272 -1.442 . . . . 0.0 113.859 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 48.4 t 62.05 -157.74 0.33 Allowed 'General case' 0 CA--C 1.561 1.374 0 CA-C-N 116.947 0.374 . . . . 0.0 110.713 176.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -175.66 -62.75 0.06 OUTLIER Glycine 0 N--CA 1.433 -1.506 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 134' ' ' GLY . . . . . 0.403 ' N ' ' HG2' ' B' ' 138' ' ' GLU . . . 94.14 121.68 3.42 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.926 -0.654 . . . . 0.0 111.785 -178.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 151.78 -49.72 0.53 Allowed Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.529 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 23.2 t -159.87 -78.55 0.06 Allowed 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 116.885 0.343 . . . . 0.0 111.711 -178.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 70.5 mt -97.17 -30.38 13.04 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-O 121.811 0.815 . . . . 0.0 111.132 -173.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.571 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 0.0 OUTLIER -77.75 -13.19 59.97 Favored 'General case' 0 C--N 1.291 -1.96 0 C-N-CA 124.866 1.267 . . . . 0.0 112.97 -172.901 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 34.6 t -49.28 -59.41 3.71 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.56 0.744 . . . . 0.0 111.233 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -140.4 73.05 1.41 Allowed 'General case' 0 CA--C 1.494 -1.179 0 CA-C-O 122.093 0.949 . . . . 0.0 109.025 174.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.517 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 26.8 ptt? -102.92 -18.67 14.95 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.633 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -22.02 -65.42 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 126.876 2.071 . . . . 0.0 116.218 -174.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.4 p -69.84 -43.92 70.97 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.256 0.551 . . . . 0.0 112.01 -176.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 45.8 mm -69.57 -40.54 79.7 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.465 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 13.2 tt -67.42 -36.78 77.47 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.863 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -55.03 -51.64 65.65 Favored 'General case' 0 C--O 1.25 1.11 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.3 m -61.48 -52.36 64.83 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-N 114.509 -1.223 . . . . 0.0 112.567 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -68.52 -47.83 65.94 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.48 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 2.5 tm? -76.03 -40.79 52.68 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 114.953 -1.021 . . . . 0.0 112.756 -168.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . 0.299 3.7 ppp? -150.23 -48.55 0.13 Allowed 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 117.86 2.541 . . . . 0.0 117.86 -175.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 27.5 t70 46.1 88.54 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 124.453 1.101 . . . . 0.0 113.034 -178.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.303 0 CA-C-O 118.528 -0.749 . . . . 0.0 109.168 179.996 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.481 -2.04 0 N-CA-C 110.734 -0.947 . . . . 0.0 110.734 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 82.1 t -111.07 119.43 59.61 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.104 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.5 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -68.46 109.43 3.69 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.844 0.83 . . . . 0.0 109.585 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.624 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.3 ptpt -130.63 105.38 7.78 Favored 'General case' 0 C--N 1.28 -2.419 0 CA-C-N 114.603 -1.18 . . . . 0.0 112.048 -176.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.15 -9.65 84.1 Favored Glycine 0 C--O 1.24 0.517 0 CA-C-N 115.076 -0.965 . . . . 0.0 113.273 -175.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.624 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 65.0 p-90 -68.73 -7.59 35.07 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -59.83 -26.17 65.57 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 120.977 0.418 . . . . 0.0 111.703 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -86.81 0.33 55.04 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.547 0.689 . . . . 0.0 110.677 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -104.95 3.01 30.28 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.953 -178.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.773 HG22 ' HB3' ' A' ' 61' ' ' ARG . 1.5 t -119.28 128.51 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.681 0 N-CA-C 103.968 -2.604 . . . . 0.0 103.968 176.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.478 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -77.66 151.46 34.26 Favored 'General case' 0 C--N 1.275 -2.665 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -61.32 -36.15 79.35 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 174.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 32.8 t70 -72.66 -27.83 62.35 Favored 'General case' 0 C--O 1.199 -1.581 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.619 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.449 ' H ' ' HB ' ' A' ' 11' ' ' THR . 3.2 tm? -70.03 -52.95 19.92 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -177.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 1.1 ptm180 -57.89 -48.67 79.16 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 175.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.4 m -67.89 -21.19 65.16 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.192 0.52 . . . . 0.0 111.816 -177.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.446 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 15.9 t60 -69.63 -47.24 64.11 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 175.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.648 HD23 HD21 ' A' ' 68' ' ' LEU . 1.2 mp -64.83 -40.52 95.31 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.768 177.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' ARG . 78.8 t -56.69 -50.38 74.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.68 0.792 . . . . 0.0 109.939 174.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 27.0 t-80 -54.86 -44.15 73.74 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.861 0.864 . . . . 0.0 109.907 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.4 ' HZ3' ' CD1' ' B' ' 145' ' ' ILE . 76.7 mttt -69.48 -36.63 76.72 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.924 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' HG22 ' A' ' 26' ' ' ILE . 63.7 mt -56.38 -45.28 80.64 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 175.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.428 ' HA ' HG22 ' A' ' 26' ' ' ILE . 42.1 t -54.88 -55.56 15.26 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.41 0 O-C-N 124.211 0.944 . . . . 0.0 109.907 172.26 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -56.63 -30.1 62.93 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -176.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.606 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.32 -45.14 16.62 Favored 'General case' 0 C--O 1.208 -1.081 0 O-C-N 122.18 -0.325 . . . . 0.0 111.717 175.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.428 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.8 tt -70.82 -34.92 58.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 122.051 0.929 . . . . 0.0 110.304 -179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.467 ' CD2' HD22 ' A' ' 43' ' ' LEU . 11.0 m-85 -136.99 88.01 18.35 Favored Pre-proline 0 C--N 1.267 -3.003 0 C-N-CA 124.357 1.063 . . . . 0.0 109.751 -177.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -44.76 133.03 10.47 Favored 'Trans proline' 0 CA--C 1.487 -1.864 0 C-N-CA 122.696 2.264 . . . . 0.0 112.431 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 m -90.27 117.92 68.41 Favored Pre-proline 1 N--CA 1.364 -4.737 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.746 -173.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.471 ' HA ' ' O ' ' B' ' 124' ' ' ASP . 55.2 Cg_endo -76.29 -32.38 4.04 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.702 2.268 . . . . 0.0 111.745 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -153.59 144.17 15.83 Favored Pre-proline 0 CA--C 1.489 -1.372 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 -177.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.449 ' HA ' HD12 ' A' ' 35' ' ' LEU . 9.4 Cg_endo -56.02 -23.25 42.71 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.68 2.253 . . . . 0.0 113.817 176.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.26 -14.18 60.88 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 121.377 -0.827 . . . . 0.0 111.719 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 40' ' ' MET . . . -72.29 -15.55 61.9 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.697 0.761 . . . . 0.0 109.487 176.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.85 ' HA ' ' HE3' ' A' ' 40' ' ' MET . 10.4 mt -88.32 -0.87 57.63 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.043 -176.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.39 16.82 4.04 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.648 0.737 . . . . 0.0 109.29 176.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.584 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 17.0 t70 -86.36 173.55 9.62 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.109 -176.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.67 -25.68 62.21 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.025 0.44 . . . . 0.0 110.651 174.262 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.588 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 6.4 tpt180 -62.84 -38.09 89.4 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 175.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.85 ' HE3' ' HA ' ' A' ' 35' ' ' LEU . 9.3 tpp -56.16 -37.18 69.19 Favored 'General case' 0 C--O 1.192 -1.932 0 CA-C-N 113.574 -1.648 . . . . 0.0 112.691 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -61.79 -32.73 73.04 Favored 'General case' 0 C--O 1.212 -0.887 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.652 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -77.21 -43.5 33.43 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-O 121.406 0.622 . . . . 0.0 110.0 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 20.5 mt -63.72 -45.71 88.7 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.644 -178.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.839 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.0 p -73.34 -28.58 25.84 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.368 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.13 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.24 -44.23 95.43 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 176.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.531 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.5 t80 -62.51 -45.8 91.33 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.888 173.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.72 91.55 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.943 -177.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -68.25 -41.05 81.71 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 123.608 0.763 . . . . 0.0 112.375 178.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.531 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 58.3 pttt -65.84 -40.3 91.6 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 55.5 t -71.06 -48.33 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.884 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -58.25 -45.72 87.28 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.85 -42.42 96.6 Favored Glycine 0 N--CA 1.433 -1.522 0 O-C-N 123.928 0.768 . . . . 0.0 112.744 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -58.18 -54.7 44.03 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.489 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.6 OUTLIER -67.0 -33.9 76.56 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.502 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -63.62 -45.17 91.52 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -79.05 -16.59 56.59 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 121.888 -0.507 . . . . 0.0 111.727 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.489 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 29.9 m -87.1 -27.81 22.89 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.63 167.39 15.38 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.52 0.676 . . . . 0.0 112.576 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -115.31 8.63 15.47 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.532 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.4 p -166.66 150.27 7.05 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 175.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.773 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -60.82 -34.15 74.1 Favored 'General case' 0 C--O 1.199 -1.598 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.3 175.966 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.78 -47.91 83.79 Favored 'General case' 0 C--O 1.219 -0.542 0 O-C-N 123.857 0.723 . . . . 0.0 109.571 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -62.96 -47.34 83.61 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.715 177.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.407 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.57 -46.39 82.94 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.875 -176.768 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -60.92 -44.87 96.59 Favored 'General case' 0 C--O 1.208 -1.13 0 O-C-N 123.84 0.713 . . . . 0.0 109.752 177.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.426 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 53.6 t-80 -58.43 -57.21 13.95 Favored 'General case' 0 C--N 1.323 -0.543 0 O-C-N 123.606 0.566 . . . . 0.0 111.815 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.473 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.7 pp -65.41 -37.11 85.97 Favored 'General case' 0 C--O 1.27 2.156 0 CA-C-O 121.317 0.579 . . . . 0.0 112.167 -175.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.648 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -70.7 -36.89 73.48 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 -179.174 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.52 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.72 -38.39 90.28 Favored 'General case' 0 C--O 1.209 -1.077 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.232 178.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 53.5 mm-40 -61.15 -51.23 69.93 Favored 'General case' 0 C--O 1.262 1.735 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.701 179.265 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -39.38 81.11 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.587 -0.845 . . . . 0.0 112.621 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.582 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 6.8 tt -64.49 -44.89 96.96 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.891 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.803 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.411 ' CE1' ' HE2' ' A' ' 77' ' ' LYS . 65.3 t80 -53.4 -52.79 58.19 Favored 'General case' 0 C--O 1.259 1.574 0 C-N-CA 125.227 1.411 . . . . 0.0 111.238 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.67 -32.26 73.72 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.808 -178.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.606 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.5 mp -70.83 -35.63 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.298 176.057 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 72' ' ' ILE . 22.7 mm-40 -60.03 -47.58 85.25 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 122.08 0.943 . . . . 0.0 109.703 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.1 OUTLIER -72.79 -28.12 62.4 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.521 -0.872 . . . . 0.0 112.872 178.605 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.455 ' OE2' HD22 ' B' ' 111' ' ' LEU . 0.6 OUTLIER -60.39 -53.43 57.73 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 175.609 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -60.35 -41.59 93.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.941 -177.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.479 ' HB3' ' NH2' ' A' ' 84' ' ' ARG . 12.5 mm-40 -59.1 -53.67 55.7 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.239 176.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.9 pt-20 -71.58 -37.76 70.99 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -174.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -33.36 62.34 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -75.65 -31.64 59.89 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.852 0.834 . . . . 0.0 109.915 178.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.479 ' NH2' ' HB3' ' A' ' 80' ' ' GLU . 34.2 ttm180 -75.1 -21.39 58.93 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.702 -1.136 . . . . 0.0 109.237 175.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 54.8 m 86.19 128.88 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 126.482 1.913 . . . . 0.0 113.16 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.428 ' HG3' HD12 ' A' ' 87' ' ' LEU . 12.1 ptt180 -133.05 -29.98 1.39 Allowed 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.782 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.428 HD12 ' HG3' ' A' ' 86' ' ' ARG . 8.7 mp . . . . . 0 N--CA 1.473 0.698 0 O-C-N 122.166 -0.334 . . . . 0.0 110.159 175.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.508 -0.383 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 7.6 p -69.83 -21.6 63.36 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 123.398 0.679 . . . . 0.0 112.355 -176.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 96.8 mmm -93.27 3.06 56.28 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.577 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 45.6 t 66.48 -176.11 0.19 Allowed 'General case' 0 CA--C 1.549 0.928 0 O-C-N 123.716 0.635 . . . . 0.0 110.511 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -105.96 -5.41 19.62 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -89.38 176.55 6.88 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.784 177.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.51 -39.19 2.91 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -136.6 23.4 3.15 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 5.2 pm0 -56.74 -40.69 76.2 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.516 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 22.7 m -73.4 -32.57 64.51 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.391 -176.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.455 HD22 ' OE2' ' A' ' 78' ' ' GLU . 7.8 mt -66.3 -47.93 72.0 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -175.465 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -71.69 -41.64 68.38 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.647 -177.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.74 -53.26 60.08 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-O 121.883 0.849 . . . . 0.0 109.453 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.419 HD21 ' HB3' ' A' ' 79' ' ' LEU . 50.8 tp -67.51 -27.12 66.72 Favored 'General case' 0 C--O 1.189 -2.115 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.783 -179.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.412 ' HA ' ' HB3' ' B' ' 118' ' ' ASP . 59.0 tp -68.6 -40.01 80.64 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 121.334 0.588 . . . . 0.0 109.685 176.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 36.6 m -60.72 -38.1 83.97 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.14 178.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.4 m -72.27 -50.46 26.98 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-O 121.388 0.613 . . . . 0.0 111.062 174.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' B' ' 115' ' ' LEU . 3.2 t70 -56.05 -18.61 10.03 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 126.766 2.026 . . . . 0.0 113.941 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 78.6 p -56.78 -19.34 16.52 Favored 'General case' 0 CA--C 1.562 1.415 0 CA-C-O 120.905 0.383 . . . . 0.0 111.654 174.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 39.3 tp -66.95 -47.02 72.91 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.86 0.864 . . . . 0.0 111.434 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 7.3 p -77.12 -40.72 44.7 Favored 'General case' 0 C--O 1.245 0.853 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -174.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 55.2 m-70 72.59 -72.98 0.1 Allowed 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.473 1.109 . . . . 0.0 110.955 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 20.9 t 171.57 85.48 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 104.051 -2.574 . . . . 0.0 104.051 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 124' ' ' ASP . . . . . 0.471 ' O ' ' HA ' ' A' ' 30' ' ' PRO . 24.4 t70 -175.92 128.71 0.23 Allowed 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -171.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -151.72 101.92 0.22 Allowed Glycine 0 N--CA 1.44 -1.053 0 C-N-CA 120.981 -0.628 . . . . 0.0 111.847 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -92.34 9.31 76.38 Favored Glycine 0 C--N 1.308 -1.025 0 N-CA-C 114.49 0.556 . . . . 0.0 114.49 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 148.41 167.36 13.56 Favored Glycine 0 C--N 1.312 -0.751 0 C-N-CA 119.971 -1.109 . . . . 0.0 112.656 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 28.2 t -164.61 -159.06 0.44 Allowed 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 94.71 -68.45 1.26 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.626 -0.321 . . . . 0.0 112.669 178.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 87.34 -106.24 3.15 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.724 -0.75 . . . . 0.0 111.748 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -160.51 179.11 36.22 Favored Glycine 0 N--CA 1.435 -1.376 0 N-CA-C 111.064 -0.814 . . . . 0.0 111.064 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 20.1 m -154.14 123.3 6.44 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -83.39 -133.16 2.13 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.645 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -174.13 79.25 0.08 OUTLIER Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.39 -0.91 . . . . 0.0 111.735 179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -127.91 -40.69 0.3 Allowed Glycine 0 C--N 1.295 -1.7 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 16.6 p -140.75 -79.48 0.27 Allowed 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 39.4 mt -105.06 -17.3 14.54 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -172.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.465 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 0.0 OUTLIER -82.23 -13.03 57.69 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 -167.418 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 48.5 t -72.15 -60.0 2.45 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 118.742 0.701 . . . . 0.0 110.964 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -109.8 66.16 0.63 Allowed 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 179.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.439 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 25.4 ttt -102.66 -22.74 13.92 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 113.994 -1.457 . . . . 0.0 113.539 -170.07 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -42.37 -53.36 4.25 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 -169.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.3 p -64.82 -50.43 66.73 Favored 'General case' 0 C--O 1.255 1.375 0 CA-C-O 121.55 0.691 . . . . 0.0 111.115 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 63.2 mt -58.0 -50.77 76.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.78 -177.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.483 HD11 HD22 ' B' ' 149' ' ' LEU . 0.0 OUTLIER -67.01 -40.37 85.41 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.276 -177.252 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.446 ' HA ' ' O ' ' B' ' 150' ' ' MET . 16.5 ttp180 -64.61 -58.5 6.18 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 118.954 -1.098 . . . . 0.0 111.23 -176.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.9 m -66.1 -41.1 91.07 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 -175.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -81.6 -48.05 12.26 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.349 0.499 . . . . 0.0 112.349 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.508 HD21 HD13 ' A' ' 72' ' ' ILE . 9.4 tt -95.86 -42.83 8.13 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -170.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.446 ' O ' ' HA ' ' B' ' 146' ' ' ARG . 0.0 OUTLIER -178.16 130.21 0.14 Allowed 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.625 1.102 . . . . 0.0 113.229 -178.909 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -119.57 -58.95 1.87 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 105.156 -2.165 . . . . 0.0 105.156 172.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.446 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 172.699 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.482 -1.988 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.451 ' O ' ' HG3' ' A' ' 4' ' ' LYS . 58.3 t 66.15 104.24 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.044 0.937 . . . . 0.0 109.627 -175.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.6 106.65 6.28 Favored 'General case' 0 C--N 1.278 -2.523 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.032 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 2' ' ' VAL . 43.6 mttp -104.98 123.08 47.17 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.184 -0.916 . . . . 0.0 108.891 -177.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.43 -15.47 61.47 Favored Glycine 0 C--N 1.315 -0.639 0 O-C-N 123.428 0.455 . . . . 0.0 113.88 -174.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -72.38 -8.35 54.5 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 122.335 -0.509 . . . . 0.0 112.355 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.4 p-80 -62.4 -21.89 65.73 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.315 0.579 . . . . 0.0 110.425 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.17 -7.44 57.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.985 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -112.91 18.01 18.48 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.936 -178.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.57 125.48 19.05 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.23 159.24 19.52 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -176.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -59.01 -38.21 78.71 Favored 'General case' 0 C--O 1.208 -1.096 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 170.28 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.518 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 6.6 m-20 -65.86 -31.24 72.07 Favored 'General case' 0 C--O 1.202 -1.421 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.57 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -67.55 -51.88 45.44 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 179.295 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.58 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.0 ptm180 -64.61 -46.78 81.15 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.209 -1.359 . . . . 0.0 112.536 -177.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.6 t -66.45 -23.19 66.24 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-O 121.275 0.56 . . . . 0.0 110.899 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.518 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 9.5 t60 -69.54 -47.35 64.01 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 176.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.806 HD23 HD21 ' A' ' 68' ' ' LEU . 5.2 mp -65.01 -41.57 95.23 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.323 -1.308 . . . . 0.0 109.898 177.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 15' ' ' ARG . 67.7 t -55.81 -48.67 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 124.115 0.966 . . . . 0.0 110.39 175.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -55.75 -48.82 74.61 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.433 178.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.439 ' HE2' ' O ' ' B' ' 130' ' ' GLY . 37.5 mttm -65.1 -37.31 87.07 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.026 178.443 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.464 ' O ' HG22 ' A' ' 26' ' ' ILE . 57.2 mt -53.51 -49.33 67.79 Favored 'General case' 0 CA--C 1.502 -0.869 0 O-C-N 123.577 0.548 . . . . 0.0 109.8 175.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.499 HG11 ' HE1' ' A' ' 40' ' ' MET . 58.6 t -54.87 -51.88 48.43 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.147 0 O-C-N 124.328 1.017 . . . . 0.0 110.172 175.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -56.72 -31.94 65.02 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -177.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.535 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.14 -45.94 15.65 Favored 'General case' 0 C--O 1.215 -0.757 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 176.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.464 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -79.9 -27.38 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-O 122.055 0.931 . . . . 0.0 111.013 -173.719 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -133.17 87.37 39.27 Favored Pre-proline 0 C--N 1.285 -2.21 0 C-N-CA 124.516 1.126 . . . . 0.0 108.997 177.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -58.37 116.1 3.01 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.164 1.909 . . . . 0.0 110.48 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.2 t -88.93 132.41 38.27 Favored Pre-proline 0 N--CA 1.424 -1.741 0 CA-C-O 121.104 0.478 . . . . 0.0 111.308 -174.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.63 -28.7 13.86 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.595 2.197 . . . . 0.0 111.331 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -148.98 155.61 40.48 Favored Pre-proline 0 C--N 1.31 -1.117 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.483 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.512 ' HA ' HD12 ' A' ' 35' ' ' LEU . 57.1 Cg_endo -73.52 -7.44 20.29 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.005 1.803 . . . . 0.0 114.367 179.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.59 -20.62 26.15 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 121.519 -0.738 . . . . 0.0 110.049 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.77 -12.31 58.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.863 0.839 . . . . 0.0 110.031 174.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 32' ' ' PRO . 27.6 mt -89.53 2.14 54.99 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.029 -179.253 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.89 9.93 4.22 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.742 0.782 . . . . 0.0 109.432 175.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.637 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 15.7 t70 -86.78 174.28 8.9 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 124.888 1.275 . . . . 0.0 111.004 -175.457 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.637 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -64.69 -29.19 70.18 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 123.266 0.626 . . . . 0.0 111.17 179.454 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.537 ' O ' HD13 ' A' ' 43' ' ' LEU . 41.2 ttm180 -66.38 -37.24 84.81 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 177.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.809 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 7.5 tpp -58.06 -35.56 71.53 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.716 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.2 pt-20 -61.64 -30.98 71.07 Favored 'General case' 0 C--O 1.209 -1.077 0 C-N-CA 118.63 -1.228 . . . . 0.0 109.369 -178.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -74.8 -46.44 36.82 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.461 177.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.624 HD22 ' HA ' ' A' ' 40' ' ' MET . 1.2 mp -55.1 -58.39 7.87 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.342 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.809 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.8 p -69.59 -29.27 40.82 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.346 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.744 -176.155 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.3 -47.45 85.35 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.554 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.3 t80 -59.93 -44.83 94.11 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 174.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.42 -42.29 99.34 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.055 -177.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -65.3 -44.11 88.97 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 123.2 0.6 . . . . 0.0 111.002 178.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.554 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 53.7 pttt -65.25 -40.71 94.37 Favored 'General case' 0 C--O 1.246 0.877 0 CA-C-O 121.284 0.564 . . . . 0.0 110.623 -178.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.446 HG21 ' CE2' ' A' ' 46' ' ' TYR . 43.0 t -70.95 -44.21 75.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.953 178.482 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -56.89 -46.66 81.73 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.09 -34.29 88.54 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.202 177.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 30.0 t70 -61.21 -53.8 52.34 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.005 0.431 . . . . 0.0 110.326 178.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.457 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -70.35 -31.07 68.19 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.701 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -59.47 -48.82 80.18 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -76.78 -24.9 52.88 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.516 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.8 t -80.33 -11.23 59.73 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -107.53 165.63 11.27 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.975 0.416 . . . . 0.0 111.503 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -112.39 14.21 20.34 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.376 0.607 . . . . 0.0 111.529 177.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 99.6 p -162.26 153.53 17.99 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 171.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.514 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -58.59 -41.18 85.19 Favored 'General case' 0 C--O 1.192 -1.932 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.978 174.525 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -65.35 -39.92 92.98 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.435 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -63.53 -50.43 69.6 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.145 175.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.467 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -62.7 -44.24 96.75 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.827 -177.892 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.48 -46.82 88.71 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 124.166 0.916 . . . . 0.0 110.44 177.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.595 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 24.2 t60 -63.38 -50.96 67.83 Favored 'General case' 0 C--O 1.202 -1.419 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.271 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.457 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -64.68 -37.66 88.33 Favored 'General case' 0 C--O 1.276 2.493 0 CA-C-O 121.514 0.674 . . . . 0.0 111.877 -176.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.806 HD21 HD23 ' A' ' 18' ' ' LEU . 1.5 pp -69.59 -35.5 75.38 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 178.171 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.542 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.83 -35.5 80.83 Favored 'General case' 0 C--O 1.204 -1.298 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.747 177.202 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 26.6 mt-10 -66.23 -47.37 74.02 Favored 'General case' 0 C--O 1.252 1.233 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.861 -179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -40.47 87.96 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 118.578 -1.249 . . . . 0.0 110.599 -178.173 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.542 HG22 ' HA ' ' A' ' 69' ' ' ALA . 4.4 tt -65.74 -44.13 93.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.117 -178.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.441 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 53.9 t80 -56.39 -53.11 61.25 Favored 'General case' 0 C--O 1.273 2.304 0 C-N-CA 125.36 1.464 . . . . 0.0 110.947 -178.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.5 ptpt -63.48 -39.55 94.74 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.661 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.535 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -61.89 -39.21 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 123.343 0.402 . . . . 0.0 111.514 178.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.7 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 1.9 mm100 -60.1 -53.48 57.28 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.452 ' HB3' ' HE2' ' A' ' 77' ' ' LYS . 6.7 ptpt -73.6 -28.78 62.0 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.469 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 8.1 tp10 -59.29 -47.94 83.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 175.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.1 pp -67.27 -37.42 83.42 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.188 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.492 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 4.7 mm-40 -61.12 -53.19 60.1 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.0 pt-20 -73.36 -32.96 64.82 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.073 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.556 ' HE2' ' HG3' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -66.07 -31.03 71.67 Favored 'General case' 0 C--N 1.352 0.674 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.095 179.081 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.556 ' HG3' ' HE2' ' A' ' 82' ' ' LYS . 51.3 mtm180 -78.11 -39.47 41.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.866 173.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 54.3 ttt180 -71.6 -60.63 2.13 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 114.841 1.423 . . . . 0.0 114.841 -169.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.1 t -177.55 27.56 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 119.104 -1.039 . . . . 0.0 113.79 -171.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.456 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 1.1 ptp180 -84.6 -14.12 49.66 Favored 'General case' 0 C--N 1.31 -1.149 0 C-N-CA 117.452 -1.699 . . . . 0.0 110.033 176.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--N 1.305 -1.355 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 173.567 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.929 0 N-CA-C 111.144 -0.782 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 18.6 m 61.98 29.42 17.74 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.816 0.847 . . . . 0.0 109.507 -178.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 60.0 mtt -69.84 -30.26 67.71 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.052 -172.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 40.9 m 61.56 32.23 18.7 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.797 0.808 . . . . 0.0 111.36 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 29.5 m170 -105.27 -52.99 2.73 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 121.751 0.786 . . . . 0.0 109.242 178.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -69.66 136.42 51.1 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.732 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 118.61 -49.04 0.89 Allowed Glycine 0 N--CA 1.423 -2.177 0 N-CA-C 108.484 -1.846 . . . . 0.0 108.484 -175.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -157.98 73.75 0.69 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 122.204 1.002 . . . . 0.0 108.832 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.87 -22.31 34.06 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.119 -1.4 . . . . 0.0 108.933 176.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 10.4 t -63.66 -27.31 69.14 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.76 -176.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.79 -43.42 96.38 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -71.78 -41.62 68.12 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.917 -176.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.63 -47.22 87.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.437 -0.802 . . . . 0.0 108.967 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.546 HD21 ' HB3' ' A' ' 79' ' ' LEU . 50.7 tp -65.37 -34.14 77.6 Favored 'General case' 0 C--O 1.19 -2.042 0 CA-C-N 114.651 -1.159 . . . . 0.0 111.43 179.289 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 55.6 tp -65.61 -33.73 76.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.104 0.478 . . . . 0.0 109.829 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 31.3 m -64.45 -45.38 87.67 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.417 175.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.406 ' O ' ' HB3' ' B' ' 120' ' ' LEU . 13.0 m -67.77 -35.21 78.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 121.746 0.784 . . . . 0.0 110.095 176.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 6.4 t70 -63.82 -31.95 73.29 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 125.494 1.518 . . . . 0.0 109.903 -178.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 27.0 m -64.51 -24.98 67.79 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.711 178.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.406 ' HB3' ' O ' ' B' ' 117' ' ' SER . 7.7 tt -74.47 -32.4 62.56 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 121.425 0.631 . . . . 0.0 109.464 178.211 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 33.7 t -76.82 -15.34 59.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.369 177.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 67.26 23.31 9.4 Favored 'General case' 0 C--O 1.242 0.685 0 C-N-CA 124.073 0.949 . . . . 0.0 108.468 -173.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 50.9 m 60.04 44.19 13.53 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 114.05 -1.432 . . . . 0.0 111.51 -178.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -81.65 -53.94 5.81 Favored 'General case' 0 C--O 1.247 0.944 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.565 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 152.91 -171.72 31.95 Favored Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 109.054 -1.618 . . . . 0.0 109.054 -178.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -120.07 16.16 10.11 Favored Glycine 0 C--N 1.315 -0.634 0 C-N-CA 120.185 -1.007 . . . . 0.0 112.764 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 72.82 -157.74 52.7 Favored Glycine 0 N--CA 1.443 -0.899 0 N-CA-C 111.777 -0.529 . . . . 0.0 111.777 -178.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.6 m -97.07 129.63 44.47 Favored 'General case' 0 N--CA 1.426 -1.653 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -72.77 94.7 0.68 Allowed Glycine 0 C--N 1.313 -0.74 0 C-N-CA 120.416 -0.897 . . . . 0.0 111.952 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 130' ' ' GLY . . . . . 0.439 ' O ' ' HE2' ' A' ' 21' ' ' LYS . . . -114.04 -159.38 13.01 Favored Glycine 0 C--N 1.314 -0.645 0 C-N-CA 121.502 -0.38 . . . . 0.0 112.891 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 145.0 166.33 11.61 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 10.4 t -143.72 -176.74 5.09 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 118.27 1.035 . . . . 0.0 109.535 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 135.4 170.03 12.01 Favored Glycine 0 N--CA 1.442 -0.94 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -178.44 89.67 0.08 OUTLIER Glycine 0 N--CA 1.447 -0.612 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -146.92 -29.73 0.07 OUTLIER Glycine 0 N--CA 1.438 -1.217 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.517 -178.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 16.3 p -145.41 -70.5 0.27 Allowed 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 117.378 0.589 . . . . 0.0 112.297 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.644 ' O ' ' HB2' ' B' ' 141' ' ' MET . 71.9 mt -105.26 -32.85 8.43 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 120.846 0.355 . . . . 0.0 111.272 -177.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.421 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 0.0 OUTLIER -75.53 -13.22 60.35 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 115.854 1.798 . . . . 0.0 115.854 -165.042 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 44.8 t -73.59 -39.29 64.72 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 119.159 -1.016 . . . . 0.0 110.245 -178.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -115.67 22.41 13.15 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.621 -176.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.644 ' HB2' ' O ' ' B' ' 137' ' ' LEU . 44.4 ttp -90.57 -12.84 35.87 Favored 'General case' 0 C--O 1.205 -1.244 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -171.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -38.24 -60.13 0.81 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 116.519 2.044 . . . . 0.0 116.519 -174.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.9 m -66.78 -39.67 87.89 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.22 0.533 . . . . 0.0 110.212 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 86.2 mt -64.98 -53.01 46.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.847 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.507 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 18.4 tt -68.37 -31.6 52.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 120.928 0.394 . . . . 0.0 112.061 -175.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -69.45 -51.52 35.38 Favored 'General case' 0 N--CA 1.419 -1.993 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.688 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 53.6 p -67.4 -42.45 83.28 Favored 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -80.62 -40.28 25.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -176.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.496 HD23 ' HG3' ' B' ' 150' ' ' MET . 10.0 tt -98.55 -36.37 9.93 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -171.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.496 ' HG3' HD23 ' B' ' 149' ' ' LEU 0.281 4.6 ppp? -169.78 97.31 0.3 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.153 0.978 . . . . 0.0 112.602 179.176 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -97.85 12.6 33.46 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.609 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.367 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.583 -179.185 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.486 -1.772 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.3 t -81.45 116.67 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 179.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.553 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -63.6 101.49 0.35 Allowed 'General case' 0 C--N 1.299 -1.623 0 O-C-N 124.037 0.835 . . . . 0.0 111.046 178.881 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.426 ' HB2' ' NE1' ' A' ' 6' ' ' TRP . 13.8 ptpt -130.86 90.45 2.9 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.521 177.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.9 -20.25 1.77 Allowed Glycine 0 N--CA 1.473 1.136 0 C-N-CA 125.7 1.619 . . . . 0.0 116.842 -171.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.426 ' NE1' ' HB2' ' A' ' 4' ' ' LYS . 65.6 p-90 -66.12 -15.07 62.79 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 117.444 0.622 . . . . 0.0 111.562 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.571 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 43.0 p-80 -59.8 -25.08 64.65 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.171 0.588 . . . . 0.0 111.634 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -84.81 -9.33 58.27 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 120.921 0.391 . . . . 0.0 110.85 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 48.9 m80 -88.83 -8.01 55.12 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 121.389 0.614 . . . . 0.0 109.557 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.779 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -106.17 140.97 22.54 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 N-CA-C 105.664 -1.976 . . . . 0.0 105.664 177.456 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.711 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -107.18 158.47 17.07 Favored 'General case' 0 C--N 1.276 -2.624 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -51.4 -41.49 60.76 Favored 'General case' 0 N--CA 1.438 -1.034 0 O-C-N 125.352 1.657 . . . . 0.0 109.993 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 18.7 m-20 -69.34 -39.35 78.21 Favored 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.04 179.036 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.572 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -63.62 -50.53 68.99 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 -179.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.711 ' HG2' ' O ' ' A' ' 11' ' ' THR 0.261 17.3 mmm-85 -51.54 -57.92 7.74 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 123.642 0.589 . . . . 0.0 109.704 175.978 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.0 t -66.02 -26.84 67.71 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.829 -171.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.422 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 11.0 t60 -70.54 -46.93 62.66 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.724 HD23 HD21 ' A' ' 68' ' ' LEU . 4.3 mp -68.12 -38.84 82.67 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.761 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 15' ' ' ARG . 73.7 t -56.76 -48.44 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 C-N-CA 123.618 0.767 . . . . 0.0 110.114 174.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -56.84 -49.01 76.71 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.682 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.579 ' HZ3' HG13 ' B' ' 145' ' ' ILE . 84.2 mttt -63.43 -39.83 95.52 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.769 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.482 ' O ' HG22 ' A' ' 26' ' ' ILE . 5.7 mt -51.01 -52.84 38.9 Favored 'General case' 0 CA--C 1.506 -0.75 0 O-C-N 123.99 0.806 . . . . 0.0 110.577 174.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.65 HG11 ' HE1' ' A' ' 40' ' ' MET . 59.3 t -55.54 -51.24 60.0 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.17 0 O-C-N 124.031 0.832 . . . . 0.0 110.38 176.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -54.62 -35.94 63.96 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -175.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.519 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.2 -45.54 16.18 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 178.01 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.545 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.97 -23.84 15.05 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 CA-C-O 122.251 1.024 . . . . 0.0 110.925 -174.834 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.545 ' CD2' HG23 ' A' ' 26' ' ' ILE . 63.0 m-85 -134.32 94.57 17.52 Favored Pre-proline 0 C--N 1.282 -2.358 0 C-N-CA 124.85 1.26 . . . . 0.0 107.735 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.96 89.54 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 121.906 1.737 . . . . 0.0 110.655 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.441 HG21 HD21 ' A' ' 35' ' ' LEU . 14.5 t -59.3 128.96 86.29 Favored Pre-proline 0 N--CA 1.429 -1.49 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.307 -174.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -73.78 -17.75 22.62 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 123.082 2.521 . . . . 0.0 112.059 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -160.13 146.36 11.86 Favored Pre-proline 0 CA--C 1.492 -1.282 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -61.35 -19.01 62.35 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 121.997 1.798 . . . . 0.0 113.913 176.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.05 -11.84 59.74 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.5 -0.88 . . . . 0.0 111.818 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.05 -6.61 53.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.862 0.839 . . . . 0.0 109.523 175.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.484 ' O ' ' HG2' ' A' ' 40' ' ' MET . 24.6 mt -91.36 0.9 57.45 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.059 -178.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -133.3 18.8 4.01 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 122.195 0.998 . . . . 0.0 108.63 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.587 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 27.9 t70 -96.29 177.18 5.79 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 113.811 -1.541 . . . . 0.0 112.041 -173.537 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.587 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.96 -25.11 62.58 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 124.203 1.001 . . . . 0.0 111.058 179.173 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.589 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 43.0 ttm180 -76.11 -27.84 57.25 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 176.306 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.839 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 10.7 tpp -59.02 -36.64 75.3 Favored 'General case' 0 C--O 1.197 -1.675 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.167 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 9.4 pt-20 -59.24 -32.97 70.46 Favored 'General case' 0 C--O 1.189 -2.103 0 C-N-CA 119.558 -0.857 . . . . 0.0 109.952 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -76.57 -43.33 39.32 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 123.23 0.612 . . . . 0.0 110.465 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.0 mt -63.26 -48.62 77.44 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.199 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.839 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.3 p -73.28 -28.33 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.719 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.137 -178.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -59.81 -45.67 91.64 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.58 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 13.0 t80 -61.79 -47.86 83.23 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.917 174.469 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.06 -43.05 91.67 Favored 'General case' 0 C--O 1.203 -1.372 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.234 -178.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -66.06 -39.96 90.51 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 123.7 0.8 . . . . 0.0 112.181 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -69.84 -37.36 76.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.359 0.599 . . . . 0.0 109.712 -178.287 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.414 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 65.3 t -70.98 -50.0 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.101 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.404 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.5 tm-20 -57.11 -46.79 82.33 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.964 0.906 . . . . 0.0 109.575 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.67 -40.47 98.04 Favored Glycine 0 CA--C 1.507 -0.413 0 O-C-N 123.587 0.555 . . . . 0.0 112.235 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -59.66 -54.34 47.58 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 122.785 0.434 . . . . 0.0 110.799 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.518 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.99 -34.17 77.81 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 178.118 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.571 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 68.1 t80 -59.48 -52.74 64.28 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 174.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.84 -18.55 61.44 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-O 121.705 0.764 . . . . 0.0 111.837 -179.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.464 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 17.4 m -85.46 -27.16 25.89 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -87.55 167.23 14.12 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -176.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.8 p30 -108.6 5.83 25.37 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.641 177.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.519 ' HB2' ' OD1' ' A' ' 62' ' ' ASP . 42.0 p -169.87 154.33 5.22 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 178.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.779 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -62.46 -36.24 81.82 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-O 121.247 0.546 . . . . 0.0 110.51 179.859 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.519 ' OD1' ' HB2' ' A' ' 60' ' ' SER . 1.2 p-10 -62.79 -38.62 91.4 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 124.548 1.139 . . . . 0.0 111.202 177.236 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -70.57 -44.35 67.58 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.705 0.288 . . . . 0.0 110.874 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.454 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -66.28 -43.83 85.26 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.331 -177.97 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.64 -40.11 93.72 Favored 'General case' 0 C--O 1.199 -1.566 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.514 176.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -60.2 -57.73 11.57 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.238 0.336 . . . . 0.0 111.633 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.518 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.7 pp -69.1 -30.43 68.72 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.717 -174.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.724 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -76.08 -32.57 59.31 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 119.85 -0.74 . . . . 0.0 109.073 178.366 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.527 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -66.47 -36.8 83.66 Favored 'General case' 0 C--O 1.206 -1.234 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.37 -44.14 92.34 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.757 177.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.517 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.96 -39.05 79.71 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 119.966 -0.694 . . . . 0.0 111.137 179.011 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.527 HG22 ' HA ' ' A' ' 69' ' ' ALA . 10.5 tt -68.91 -40.61 81.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.302 -179.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.558 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.1 t80 -57.49 -51.22 70.33 Favored 'General case' 0 C--O 1.261 1.669 0 C-N-CA 124.711 1.204 . . . . 0.0 111.303 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.53 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.8 ptpt -63.53 -40.6 97.44 Favored 'General case' 0 C--O 1.199 -1.565 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.519 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.5 mp -60.7 -38.77 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 O-C-N 123.717 0.636 . . . . 0.0 111.01 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.526 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 28.1 mt-30 -69.26 -45.0 70.8 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 120.265 -0.574 . . . . 0.0 111.855 -177.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.583 ' HA ' ' HG2' ' A' ' 80' ' ' GLU . 10.9 ptpt -74.35 -27.6 60.75 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 118.858 -1.137 . . . . 0.0 112.362 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 7.1 tp10 -61.02 -49.2 78.38 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 174.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.591 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.5 pp -65.9 -42.13 90.63 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -177.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.583 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 9.6 pt-20 -69.48 -39.18 77.81 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 119.444 -0.903 . . . . 0.0 112.652 -177.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -69.44 -39.59 77.73 Favored 'General case' 0 C--O 1.213 -0.817 0 C-N-CA 118.877 -1.129 . . . . 0.0 110.534 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.552 ' HD3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -69.25 -31.66 70.35 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 120.564 -0.454 . . . . 0.0 111.016 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.42 ' HG2' ' HE2' ' A' ' 82' ' ' LYS . 5.5 mmt180 -77.1 -46.61 22.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.913 178.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 22.8 tpt180 -90.61 -58.48 2.47 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 -173.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 26.8 p -165.49 97.29 0.68 Allowed 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -173.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.533 ' HD2' ' HA ' ' A' ' 82' ' ' LYS . 5.0 ptm180 -126.97 -30.65 2.7 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 119.816 -0.753 . . . . 0.0 109.362 172.027 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 C--O 1.251 1.133 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.026 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.953 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 49.1 m 62.15 25.22 15.08 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.532 1.133 . . . . 0.0 112.677 178.16 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 27.8 ttt -76.37 -30.69 57.66 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 36.1 m -111.01 136.31 50.22 Favored 'General case' 0 N--CA 1.422 -1.856 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 174.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 105' ' ' HIS . . . . . 0.43 ' O ' ' HB3' ' B' ' 109' ' ' GLN . 69.0 m80 -86.73 119.17 26.68 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -93.29 -11.92 31.33 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.649 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -71.81 99.25 0.83 Allowed Glycine 0 CA--C 1.496 -1.096 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 176.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 58.59 47.0 13.89 Favored 'General case' 0 C--O 1.249 1.055 0 CA-C-O 121.606 0.717 . . . . 0.0 110.236 -174.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.43 ' HB3' ' O ' ' B' ' 105' ' ' HIS . 3.2 pp0? -59.15 -29.77 67.68 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.54 177.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 3.5 m -55.35 -53.19 59.29 Favored 'General case' 0 N--CA 1.419 -1.992 0 C-N-CA 125.075 1.35 . . . . 0.0 110.8 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.34 -47.0 68.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.604 -176.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.464 ' O ' HG22 ' B' ' 116' ' ' THR . 11.7 pt20 -68.18 -42.29 80.19 Favored 'General case' 0 C--O 1.246 0.914 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -176.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.39 -41.03 94.14 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.591 HD21 ' HB3' ' A' ' 79' ' ' LEU . 56.0 tp -73.35 -29.08 62.42 Favored 'General case' 0 C--O 1.208 -1.123 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.745 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.552 HD13 ' HD3' ' A' ' 82' ' ' LYS . 61.8 tp -71.22 -38.4 72.0 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.372 -0.83 . . . . 0.0 110.463 178.263 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.464 HG22 ' O ' ' B' ' 112' ' ' GLN . 3.1 t -71.32 -35.84 71.37 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 119.834 -0.746 . . . . 0.0 111.644 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.1 p -69.84 -33.33 72.15 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.595 0.712 . . . . 0.0 109.874 175.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 11.9 t70 -62.91 -36.19 82.57 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 124.621 1.168 . . . . 0.0 109.976 176.453 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 30.0 m -65.77 -20.43 66.26 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.643 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 7.6 tt -71.16 -33.53 70.11 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 123.076 0.55 . . . . 0.0 110.406 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 9.4 m -76.47 -30.09 57.17 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.196 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 70.17 -62.18 0.44 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.2 1.4 . . . . 0.0 112.523 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 12.5 p -74.02 177.61 5.55 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 123.986 0.915 . . . . 0.0 113.385 -173.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -108.47 104.58 13.95 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.442 -178.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 160.93 174.73 31.14 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.501 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -146.29 105.14 0.32 Allowed Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -90.62 98.92 2.51 Favored Glycine 0 N--CA 1.442 -0.952 0 C-N-CA 121.199 -0.524 . . . . 0.0 113.359 -175.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 22.8 t -88.81 156.58 18.87 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -170.9 44.92 0.19 Allowed Glycine 0 N--CA 1.438 -1.17 0 N-CA-C 110.286 -1.125 . . . . 0.0 110.286 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -94.85 -113.71 2.63 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.554 -0.832 . . . . 0.0 112.099 -176.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 160.2 -169.31 36.04 Favored Glycine 0 N--CA 1.433 -1.506 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 -179.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 24.2 p -151.71 150.66 30.47 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 116.829 0.315 . . . . 0.0 110.28 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 147.66 150.08 5.11 Favored Glycine 0 N--CA 1.438 -1.198 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 165.96 -63.62 0.22 Allowed Glycine 0 C--N 1.296 -1.681 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 123.04 16.53 3.56 Favored Glycine 0 N--CA 1.434 -1.457 0 C-N-CA 121.367 -0.444 . . . . 0.0 112.745 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 24.5 m -118.66 -90.65 0.57 Allowed 'General case' 0 N--CA 1.423 -1.819 0 O-C-N 122.507 -0.408 . . . . 0.0 111.4 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.449 ' HB2' ' CD2' ' A' ' 14' ' ' LEU . 82.0 mt -107.07 -41.71 5.09 Favored 'General case' 0 C--O 1.204 -1.339 0 CA-C-O 121.412 0.625 . . . . 0.0 110.118 -177.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.23 -26.78 41.78 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 126.696 1.998 . . . . 0.0 113.984 -175.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 5.0 p -86.9 -12.11 48.69 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-O 121.135 0.493 . . . . 0.0 111.916 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -130.58 31.5 4.54 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 -176.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.592 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 21.1 ttt -100.81 -26.48 13.75 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 113.684 -1.598 . . . . 0.0 113.157 -166.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -34.26 -59.99 0.42 Allowed 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -172.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.4 m -69.22 -38.3 78.48 Favored 'General case' 0 C--O 1.253 1.247 0 CA-C-O 121.587 0.708 . . . . 0.0 110.43 -176.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 58.6 mt -69.94 -46.77 72.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.415 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.592 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 0.0 OUTLIER -63.56 -36.65 77.16 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.76 -179.051 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -61.4 -65.41 0.7 Allowed 'General case' 0 N--CA 1.428 -1.575 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.395 178.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.2 p -64.2 -54.02 40.08 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -173.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -80.78 -35.14 33.56 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -173.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.466 HD21 HD13 ' A' ' 72' ' ' ILE . 10.1 tt -94.6 -33.05 13.16 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -171.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 25.8 ptt? -157.5 26.91 0.29 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 116.081 -2.248 . . . . 0.0 115.033 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 15.4 t70 79.17 -77.18 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 125.617 1.567 . . . . 0.0 113.39 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.843 0 CA-C-O 118.966 -0.54 . . . . 0.0 111.377 -176.861 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.371 0 CA-C-O 119.958 -0.357 . . . . 0.0 112.895 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.3 m -136.05 154.69 34.09 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 CA-C-N 118.128 0.964 . . . . 0.0 111.385 -178.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.424 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -122.56 111.33 16.66 Favored 'General case' 0 N--CA 1.423 -1.8 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 175.123 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.429 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 10.8 ptpt -152.69 104.72 2.9 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.772 -177.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.18 -22.28 13.6 Favored Glycine 0 CA--C 1.521 0.44 0 CA-C-N 114.338 -1.301 . . . . 0.0 115.83 -175.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.429 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 56.9 p-90 -64.37 -9.41 17.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 117.734 0.767 . . . . 0.0 112.279 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -62.58 -17.04 59.27 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 122.382 0.273 . . . . 0.0 111.621 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -86.44 -10.5 54.1 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.268 0.556 . . . . 0.0 110.359 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.414 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 24.7 m-70 -87.98 5.94 38.33 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.68 0.752 . . . . 0.0 109.575 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.606 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -133.51 114.01 19.86 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.703 0 N-CA-C 105.285 -2.117 . . . . 0.0 105.285 178.564 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.72 174.74 7.84 Favored 'General case' 0 C--N 1.276 -2.592 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -63.05 -28.79 70.33 Favored 'General case' 0 C--O 1.202 -1.399 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -57.72 -48.25 80.11 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 178.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.607 ' HB2' ' HG2' ' B' ' 138' ' ' GLU . 3.4 tm? -66.4 -54.45 24.21 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -175.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.541 ' O ' HG23 ' A' ' 19' ' ' VAL . 2.8 ptm180 -60.9 -45.16 95.7 Favored 'General case' 0 N--CA 1.42 -1.956 0 CA-C-N 114.629 -1.169 . . . . 0.0 113.996 -178.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.1 t -65.3 -30.35 71.2 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 117.816 0.28 . . . . 0.0 110.756 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -66.31 -45.16 81.27 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.834 HD23 HD21 ' A' ' 68' ' ' LEU . 6.3 mp -66.33 -40.23 89.75 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.497 178.348 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.5 t -58.98 -49.75 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 124.022 0.929 . . . . 0.0 110.271 175.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -54.84 -44.13 73.66 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.969 0.908 . . . . 0.0 110.04 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -67.96 -41.64 82.14 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.103 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.452 ' O ' HG22 ' A' ' 26' ' ' ILE . 55.5 mt -51.91 -48.03 64.36 Favored 'General case' 0 CA--C 1.501 -0.909 0 O-C-N 123.515 0.509 . . . . 0.0 110.025 175.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.514 HG11 ' HE1' ' A' ' 40' ' ' MET . 41.8 t -55.81 -55.42 17.91 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.881 0 O-C-N 124.284 0.99 . . . . 0.0 110.471 175.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -57.21 -29.7 63.95 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -176.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.401 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -81.48 -45.91 15.3 Favored 'General case' 0 C--O 1.21 -1.007 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 176.468 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.452 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.86 -26.31 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-O 121.961 0.886 . . . . 0.0 110.141 -174.461 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.509 ' CG ' HD22 ' A' ' 43' ' ' LEU . 14.4 m-85 -138.81 88.09 14.07 Favored Pre-proline 0 N--CA 1.418 -2.058 0 C-N-CA 125.394 1.477 . . . . 0.0 108.717 177.147 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -57.09 106.33 0.22 Allowed 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 121.74 1.626 . . . . 0.0 109.214 177.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.0 t -66.85 130.08 94.0 Favored Pre-proline 0 N--CA 1.422 -1.833 0 CA-C-O 121.161 0.505 . . . . 0.0 111.164 -174.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.91 -31.6 12.42 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.534 2.156 . . . . 0.0 111.696 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -144.81 148.1 37.94 Favored Pre-proline 0 CA--C 1.49 -1.344 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 -176.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -69.12 -12.98 35.44 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.566 1.511 . . . . 0.0 112.286 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.64 -14.53 48.35 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.408 177.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.83 -11.19 60.5 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.877 0.846 . . . . 0.0 109.037 176.028 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.448 ' HA ' ' CE ' ' A' ' 40' ' ' MET . 23.9 mt -86.92 5.47 36.9 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.414 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -136.12 6.64 3.11 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.82 -0.55 . . . . 0.0 111.556 173.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.642 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 30.9 t70 -81.31 177.56 8.92 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.698 -176.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.642 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.93 -19.3 62.59 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.566 0.698 . . . . 0.0 110.468 175.225 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.62 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 17.3 tpp180 -70.3 -31.94 69.5 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.572 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -57.95 -41.01 81.95 Favored 'General case' 0 CA--C 1.478 -1.803 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.149 -179.424 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 7.7 pt-20 -60.15 -33.98 72.91 Favored 'General case' 0 C--O 1.208 -1.122 0 O-C-N 123.785 0.678 . . . . 0.0 110.763 -175.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -73.6 -44.66 56.58 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.38 0.609 . . . . 0.0 109.901 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 8.8 mt -65.53 -45.73 82.35 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.262 -176.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 40' ' ' MET . 29.1 m -69.33 -31.45 49.6 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.139 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.205 178.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.56 -45.2 89.48 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 177.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.52 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.4 t80 -63.17 -48.6 77.72 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.57 0.544 . . . . 0.0 110.373 173.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.83 -42.04 88.29 Favored 'General case' 0 C--O 1.201 -1.499 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.188 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -68.36 -41.12 81.1 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 123.843 0.857 . . . . 0.0 111.669 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.52 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 57.3 pttt -67.06 -39.33 86.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.728 0.775 . . . . 0.0 109.546 -178.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.466 HG21 ' CE2' ' A' ' 46' ' ' TYR . 42.9 t -72.54 -45.9 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.14 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.7 tm-20 -58.02 -47.53 82.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 177.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.89 -39.35 95.38 Favored Glycine 0 N--CA 1.449 -0.48 0 O-C-N 123.646 0.591 . . . . 0.0 112.436 178.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -59.09 -54.26 49.03 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 123.703 0.801 . . . . 0.0 110.741 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.484 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.4 OUTLIER -69.98 -28.33 65.45 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 178.123 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -66.25 -47.55 73.4 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -73.48 -26.4 60.89 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.187 0.517 . . . . 0.0 111.334 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.484 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 25.6 m -75.89 -33.04 59.92 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.27 170.39 15.45 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.432 0.634 . . . . 0.0 112.237 -178.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -120.18 13.15 11.98 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.423 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.8 p -166.86 152.85 8.15 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.606 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -64.75 -27.4 68.87 Favored 'General case' 0 C--O 1.204 -1.328 0 C-N-CA 118.43 -1.308 . . . . 0.0 110.22 175.328 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -63.07 -47.71 81.75 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.78 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.1 -44.27 89.36 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.317 176.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.408 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.83 -45.35 86.51 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.583 -177.046 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.54 -41.99 98.16 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.215 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.4 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 43.6 t-80 -60.66 -52.69 64.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 70' ' ' GLU . 4.5 pp -72.04 -33.74 68.22 Favored 'General case' 0 C--O 1.264 1.848 0 CA-C-O 121.305 0.574 . . . . 0.0 111.969 -175.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.834 HD21 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -70.76 -36.5 73.13 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 179.2 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.549 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -60.94 -39.87 91.08 Favored 'General case' 0 C--O 1.188 -2.151 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.316 175.282 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 42.5 mm-40 -55.77 -51.37 67.64 Favored 'General case' 0 C--O 1.253 1.282 0 C-N-CA 122.697 0.399 . . . . 0.0 111.704 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.81 -39.01 76.79 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 118.63 -1.228 . . . . 0.0 111.924 -177.486 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.549 HG22 ' HA ' ' A' ' 69' ' ' ALA . 8.4 tt -67.65 -45.19 85.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.662 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.556 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 47.7 t80 -54.95 -51.88 64.75 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 125.571 1.548 . . . . 0.0 110.684 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.405 ' NZ ' ' HB3' ' A' ' 74' ' ' LYS . 0.4 OUTLIER -63.21 -41.22 99.12 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 120.471 -0.492 . . . . 0.0 110.53 -179.387 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.401 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.3 mp -62.83 -35.05 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 O-C-N 123.177 0.298 . . . . 0.0 111.45 178.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.525 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 1.6 mt-30 -70.75 -44.29 67.08 Favored 'General case' 0 CA--C 1.483 -1.634 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.867 -177.457 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.556 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 12.4 ptpt -74.55 -27.4 60.5 Favored 'General case' 0 N--CA 1.418 -2.027 0 C-N-CA 119.017 -1.073 . . . . 0.0 111.898 176.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.459 ' HG2' HD13 ' B' ' 111' ' ' LEU . 25.4 tt0 -67.46 -42.71 82.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 176.428 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.64 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.5 pp -65.98 -39.34 90.27 Favored 'General case' 0 C--O 1.212 -0.878 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.088 177.426 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -58.4 -52.72 64.44 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 123.726 0.641 . . . . 0.0 111.111 176.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.415 ' HG2' ' HA ' ' A' ' 78' ' ' GLU . 10.8 pt-20 -64.41 -43.23 95.02 Favored 'General case' 0 C--O 1.211 -0.926 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.982 -178.174 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.409 ' C ' ' HD2' ' A' ' 82' ' ' LYS . 0.2 OUTLIER -67.4 -33.47 75.25 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.122 0.486 . . . . 0.0 110.677 -177.799 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -75.12 -45.46 40.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.622 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -80.76 -60.34 2.34 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 -176.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.3 p 175.65 84.04 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -175.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -94.97 -23.82 17.22 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 119.279 -0.968 . . . . 0.0 109.547 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--O 1.254 1.304 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.833 175.734 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 14.7 m -87.88 111.94 21.97 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 114.549 -0.826 . . . . 0.0 109.342 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 89.4 mtp -81.14 -2.73 49.58 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.14 0.792 . . . . 0.0 113.14 -173.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 9.8 t -131.02 25.21 4.95 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.083 0.468 . . . . 0.0 109.99 -178.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -95.01 127.42 41.06 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.557 -0.857 . . . . 0.0 108.701 178.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 71.95 126.95 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.96 1.304 . . . . 0.0 111.382 -174.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.66 87.06 1.04 Allowed Glycine 0 N--CA 1.433 -1.546 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -175.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 10.7 t30 71.14 7.13 6.07 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 122.606 1.193 . . . . 0.0 110.182 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.431 ' HA ' ' HG2' ' B' ' 112' ' ' GLN . 27.3 mm-40 -76.44 -27.73 56.32 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.089 -178.157 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 10.1 t -69.12 -30.24 68.46 Favored 'General case' 0 N--CA 1.428 -1.559 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 111' ' ' LEU . . . . . 0.459 HD13 ' HG2' ' A' ' 78' ' ' GLU . 56.9 tp -74.47 -47.8 31.19 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.566 0.222 . . . . 0.0 110.827 178.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.431 ' HG2' ' HA ' ' B' ' 109' ' ' GLN . 18.5 pt20 -71.14 -31.66 68.01 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.408 -0.917 . . . . 0.0 112.132 -178.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -70.21 -35.15 73.71 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.64 HD21 ' HB3' ' A' ' 79' ' ' LEU . 26.5 tp -66.07 -31.91 73.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.543 175.503 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 40.2 tp -70.12 -33.42 71.81 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 32.3 m -64.64 -43.09 94.8 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 174.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.408 ' HB3' ' HA ' ' A' ' 27' ' ' PHE . 17.6 m -61.58 -41.99 98.2 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.429 0.633 . . . . 0.0 109.761 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -56.64 -43.58 80.44 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 124.144 0.977 . . . . 0.0 110.788 176.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 23.5 t -68.25 -15.7 63.67 Favored 'General case' 0 CA--C 1.558 1.265 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.412 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 9.2 tt -89.23 -30.3 18.61 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 176.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 19.0 t -76.5 -47.46 22.71 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.845 -178.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 44.8 m80 75.86 -51.94 0.63 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.203 1.401 . . . . 0.0 112.404 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 20.5 t -108.46 165.5 11.47 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.98 -0.45 . . . . 0.0 110.064 -176.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -84.49 80.9 9.07 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -91.04 -102.8 1.27 Allowed Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.822 -176.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 82.91 -140.81 20.44 Favored Glycine 0 N--CA 1.436 -1.319 0 N-CA-C 111.784 -0.526 . . . . 0.0 111.784 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 158.66 -27.32 0.41 Allowed Glycine 0 C--N 1.304 -1.218 0 N-CA-C 109.997 -1.241 . . . . 0.0 109.997 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 5.1 t 78.33 -47.73 0.45 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.949 1.699 . . . . 0.0 111.056 175.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 95.44 110.32 2.44 Favored Glycine 0 N--CA 1.441 -1.03 0 C-N-CA 120.985 -0.626 . . . . 0.0 113.693 176.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -142.47 168.99 25.65 Favored Glycine 0 C--N 1.297 -1.591 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 99.31 44.08 2.43 Favored Glycine 0 C--N 1.301 -1.375 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.526 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.9 p -71.23 137.83 48.98 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.639 0.257 . . . . 0.0 110.486 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -150.06 145.88 14.43 Favored Glycine 0 N--CA 1.431 -1.683 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 148.26 -142.97 10.51 Favored Glycine 0 N--CA 1.438 -1.224 0 C-N-CA 121.289 -0.481 . . . . 0.0 112.021 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -110.32 -115.45 3.65 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.128 -0.558 . . . . 0.0 114.129 -175.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 43.4 t -25.35 -75.84 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 126.776 2.03 . . . . 0.0 115.309 -174.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 67.0 mt -101.94 -15.39 16.85 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.918 0.866 . . . . 0.0 108.845 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.607 ' HG2' ' HB2' ' A' ' 14' ' ' LEU . 2.9 mt-10 -83.38 -16.24 46.74 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 113.565 -1.652 . . . . 0.0 112.003 -164.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 42.1 t -41.08 -59.78 1.39 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.139 1.376 . . . . 0.0 112.128 -176.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -169.93 83.94 0.12 Allowed 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 123.217 1.484 . . . . 0.0 107.867 173.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.409 ' HE2' ' HB ' ' B' ' 145' ' ' ILE . 16.0 ptm -92.72 -11.35 34.19 Favored 'General case' 0 C--N 1.291 -1.957 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.157 -173.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -10.4 -74.18 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 128.196 2.598 . . . . 0.0 115.554 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 5.7 m -66.54 -47.48 72.74 Favored 'General case' 0 C--O 1.253 1.251 0 C-N-CA 123.589 0.756 . . . . 0.0 112.191 -175.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 62.5 mt -65.62 -44.49 93.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.887 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.409 ' HB ' ' HE2' ' B' ' 141' ' ' MET . 12.0 tt -67.49 -36.63 76.92 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.481 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.855 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 45.6 ttt180 -55.71 -50.5 70.14 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 147' ' ' SER . . . . . 0.474 ' HA ' ' HB2' ' B' ' 151' ' ' ASP . 14.9 m -60.97 -51.86 67.46 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.651 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -76.52 -43.32 39.88 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -174.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.519 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 2.5 tm? -75.34 -42.69 53.76 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.721 -172.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.502 ' SD ' HD12 ' B' ' 149' ' ' LEU . 0.0 OUTLIER -161.29 33.12 0.14 Allowed 'General case' 0 C--O 1.247 0.968 0 N-CA-C 116.169 1.914 . . . . 0.0 116.169 -175.331 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 151' ' ' ASP . . . . . 0.474 ' HB2' ' HA ' ' B' ' 147' ' ' SER . 27.2 t70 -67.81 121.06 15.18 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 118.9 -1.12 . . . . 0.0 110.765 176.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.846 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.378 -178.392 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.488 -1.625 0 N-CA-C 111.888 -0.485 . . . . 0.0 111.888 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.409 ' HB ' ' NZ ' ' A' ' 4' ' ' LYS . 21.6 t -132.54 125.17 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.589 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 178.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.544 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -91.63 112.64 24.65 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 -178.021 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.453 ' HD2' ' HE1' ' A' ' 6' ' ' TRP . 28.8 mtmm -121.59 119.78 32.89 Favored 'General case' 0 C--N 1.28 -2.443 0 CA-C-N 114.531 -1.213 . . . . 0.0 108.578 -174.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -52.2 -25.1 17.56 Favored Glycine 0 C--O 1.243 0.709 0 N-CA-C 116.023 1.169 . . . . 0.0 116.023 -172.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.453 ' HE1' ' HD2' ' A' ' 4' ' ' LYS . 66.2 p-90 -66.59 -14.72 62.75 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 117.412 0.606 . . . . 0.0 112.009 178.542 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -59.39 -14.12 10.92 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 177.12 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -84.86 -10.26 57.31 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.46 0.648 . . . . 0.0 110.422 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -95.04 3.58 54.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.211 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.0 p -134.74 125.85 46.75 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.021 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.459 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -93.84 157.83 15.94 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.52 -177.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -52.42 -43.05 64.6 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.071 0.948 . . . . 0.0 110.049 175.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.415 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 1.9 m-20 -57.47 -37.23 72.55 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.245 -0.888 . . . . 0.0 112.191 -179.083 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.479 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -70.4 -51.45 29.48 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 -176.483 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.497 ' O ' HG23 ' A' ' 19' ' ' VAL . 3.9 ptm180 -66.17 -43.73 86.08 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.447 -1.251 . . . . 0.0 113.164 -176.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.5 t -68.42 -24.46 64.74 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-O 121.181 0.515 . . . . 0.0 109.672 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 20.2 t60 -68.92 -44.58 72.84 Favored 'General case' 0 C--O 1.246 0.915 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 176.282 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.766 HD23 HD21 ' A' ' 68' ' ' LEU . 3.7 mp -65.78 -40.65 92.2 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.705 -1.134 . . . . 0.0 110.171 177.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 15' ' ' ARG . 60.6 t -55.69 -48.46 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.602 0.761 . . . . 0.0 110.101 174.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -53.65 -50.43 65.78 Favored 'General case' 0 C--O 1.249 1.053 0 C-N-CA 123.622 0.769 . . . . 0.0 110.607 177.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -64.14 -39.8 94.8 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.814 178.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.522 ' O ' HG22 ' A' ' 26' ' ' ILE . 20.2 mt -50.96 -53.34 33.87 Favored 'General case' 0 CA--C 1.505 -0.782 0 O-C-N 123.797 0.686 . . . . 0.0 110.559 175.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.461 HG11 ' HE1' ' A' ' 40' ' ' MET . 54.7 t -54.8 -50.11 63.77 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.766 0 O-C-N 124.173 0.921 . . . . 0.0 110.786 176.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -55.34 -38.79 69.23 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -177.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.443 ' HB3' HG13 ' A' ' 72' ' ' ILE . . . -81.16 -44.56 17.7 Favored 'General case' 0 C--O 1.206 -1.235 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.834 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.597 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.22 -25.92 16.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.529 0.681 . . . . 0.0 110.725 -175.0 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.597 ' CD2' HG23 ' A' ' 26' ' ' ILE . 62.9 m-85 -128.54 91.51 43.41 Favored Pre-proline 0 C--N 1.293 -1.888 0 C-N-CA 123.858 0.863 . . . . 0.0 109.446 178.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.84 97.52 0.18 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 122.081 1.854 . . . . 0.0 110.172 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.6 t -69.73 138.37 88.17 Favored Pre-proline 0 N--CA 1.424 -1.762 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.512 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.53 -34.99 8.63 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 122.515 2.143 . . . . 0.0 111.376 178.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -142.92 150.84 54.58 Favored Pre-proline 0 CA--C 1.489 -1.381 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -65.82 -13.39 39.6 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.1 1.866 . . . . 0.0 112.088 175.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.4 -9.71 55.76 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.369 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.37 -8.77 59.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.378 1.085 . . . . 0.0 108.564 176.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.426 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.2 mt -85.6 1.57 48.61 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 114.033 -1.439 . . . . 0.0 110.291 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -133.32 20.07 4.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 122.2 1.0 . . . . 0.0 108.699 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.688 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 27.1 t70 -98.03 177.09 5.53 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.642 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.688 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -68.69 -29.03 67.38 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.725 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.582 ' O ' HD13 ' A' ' 43' ' ' LEU . 4.3 tpm_? -63.95 -34.45 78.0 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.653 ' HA ' HD22 ' A' ' 43' ' ' LEU . 5.9 tpp -58.54 -32.73 69.15 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 114.266 -1.334 . . . . 0.0 112.724 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -64.36 -31.61 72.89 Favored 'General case' 0 C--O 1.203 -1.358 0 C-N-CA 118.727 -1.189 . . . . 0.0 109.845 -178.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -72.77 -46.08 55.24 Favored 'General case' 0 CA--C 1.5 -0.949 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 175.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.653 HD22 ' HA ' ' A' ' 40' ' ' MET . 1.7 mp -53.19 -55.97 20.04 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 113.928 -1.487 . . . . 0.0 110.744 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.617 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.0 p -73.26 -29.08 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.034 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.571 -175.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.79 -47.67 84.78 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.534 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.0 t80 -61.15 -46.56 90.01 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.148 175.072 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.48 -44.45 93.04 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 120.854 -0.339 . . . . 0.0 111.21 -177.109 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -62.83 -46.24 88.83 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 123.32 0.648 . . . . 0.0 111.829 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.5 pttp -63.55 -41.84 98.41 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-O 121.306 0.574 . . . . 0.0 110.605 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.512 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 50.8 t -70.47 -43.56 77.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.053 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -58.48 -44.6 89.4 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.7 -42.49 96.34 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.179 178.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.35 -54.62 44.66 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.491 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -67.02 -30.21 70.24 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 179.612 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.6 -50.74 63.98 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -69.4 -25.12 63.98 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.246 -0.434 . . . . 0.0 112.07 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.464 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 34.5 m -79.18 -27.25 42.63 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 124.408 1.083 . . . . 0.0 113.431 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.19 162.82 16.47 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -110.71 8.32 22.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.54 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.6 p -162.49 157.97 23.02 Favored 'General case' 0 CA--C 1.487 -1.452 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 174.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.1 -26.45 62.15 Favored 'General case' 0 C--O 1.2 -1.515 0 C-N-CA 118.921 -1.112 . . . . 0.0 110.131 178.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -64.72 -45.3 87.13 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.502 176.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -63.26 -44.56 94.81 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.022 175.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -46.45 79.18 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.694 -177.222 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.86 -44.79 96.12 Favored 'General case' 0 C--O 1.209 -1.056 0 O-C-N 123.839 0.712 . . . . 0.0 110.318 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.479 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 13.8 t60 -65.46 -47.16 77.09 Favored 'General case' 0 C--O 1.209 -1.038 0 O-C-N 123.157 0.286 . . . . 0.0 111.475 -177.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.477 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.0 pp -70.5 -33.23 70.98 Favored 'General case' 0 C--O 1.255 1.381 0 C-N-CA 120.256 -0.578 . . . . 0.0 111.528 -176.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.766 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -73.23 -33.6 65.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 178.617 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.594 ' O ' ' HB2' ' A' ' 73' ' ' TYR . . . -63.7 -41.97 98.04 Favored 'General case' 0 C--O 1.183 -2.439 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.906 175.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 38.3 mm-40 -57.11 -47.37 81.25 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-O 121.462 0.649 . . . . 0.0 111.314 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.504 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -70.23 -38.62 75.26 Favored 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.908 -178.149 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.524 HG22 ' HA ' ' A' ' 69' ' ' ALA . 9.4 tt -69.68 -36.57 71.0 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-O 121.765 0.793 . . . . 0.0 109.794 -179.154 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.638 ' CD2' ' HA ' ' B' ' 150' ' ' MET . 16.9 t80 -58.55 -55.44 34.99 Favored 'General case' 0 C--O 1.279 2.646 0 C-N-CA 126.656 1.983 . . . . 0.0 109.826 -178.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.7 ptpt -64.87 -33.14 75.29 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.793 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -68.11 -41.79 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 O-C-N 123.481 0.488 . . . . 0.0 111.905 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.574 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 29.1 mt-30 -62.42 -49.01 77.17 Favored 'General case' 0 C--O 1.262 1.745 0 CA-C-O 121.198 0.523 . . . . 0.0 111.253 -178.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.2 ptpt -69.33 -31.18 69.46 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 118.75 -1.18 . . . . 0.0 111.848 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 11.4 tp10 -64.99 -47.53 77.19 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.409 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.602 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.5 pp -60.4 -43.72 96.41 Favored 'General case' 0 CA--C 1.492 -1.285 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.493 -177.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.427 ' N ' HD12 ' A' ' 79' ' ' LEU . 11.5 pt-20 -67.1 -39.15 86.66 Favored 'General case' 0 C--O 1.258 1.52 0 C-N-CA 119.35 -0.94 . . . . 0.0 112.214 -178.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -73.8 -39.26 64.23 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 119.892 -0.723 . . . . 0.0 112.211 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.493 ' HD2' ' C ' ' A' ' 82' ' ' LYS . 0.2 OUTLIER -73.44 -31.93 64.1 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 110.971 -179.429 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -66.86 -40.65 87.94 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -77.72 -59.59 2.72 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 119.89 -0.724 . . . . 0.0 110.311 178.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.4 p -178.68 97.43 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -176.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -121.75 -26.1 4.93 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 171.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 C--O 1.246 0.907 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 177.245 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.805 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 102' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' B' ' 105' ' ' HIS . 33.0 t -124.47 110.67 14.79 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -178.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 91.1 mmm -89.88 -28.8 19.0 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.628 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 25.4 p -143.33 -50.19 0.33 Allowed 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.305 -177.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 105' ' ' HIS . . . . . 0.559 ' O ' ' HB3' ' B' ' 109' ' ' GLN . 39.5 t60 68.91 22.3 7.18 Favored 'General case' 0 C--N 1.35 0.629 0 CA-C-O 122.727 1.251 . . . . 0.0 108.267 -176.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -128.03 113.34 15.68 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.24 -30.81 8.83 Favored Glycine 0 C--N 1.301 -1.384 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -123.11 9.59 9.3 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -177.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.559 ' HB3' ' O ' ' B' ' 105' ' ' HIS . 4.6 pm0 -60.39 -37.93 82.35 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.169 0.509 . . . . 0.0 110.077 -179.442 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 12.8 t -70.82 -34.48 71.75 Favored 'General case' 0 N--CA 1.416 -2.128 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.283 -173.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -66.71 -45.02 80.1 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 121.1 -0.24 . . . . 0.0 111.094 178.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -75.41 -35.53 60.99 Favored 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 119.771 -0.771 . . . . 0.0 112.465 -178.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -63.92 -45.59 88.57 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.586 175.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 79' ' ' LEU . 58.3 tp -63.13 -36.67 84.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.157 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 35.0 tp -70.69 -31.05 67.8 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 89.9 m -67.44 -43.04 82.13 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 175.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.555 ' O ' ' HG ' ' B' ' 120' ' ' LEU . 15.0 m -57.98 -46.37 85.28 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.708 0.765 . . . . 0.0 110.408 176.098 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -62.19 -42.64 99.47 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.745 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 38.0 t -64.97 -41.75 95.18 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.08 179.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' B' ' 117' ' ' SER . 3.7 pp -68.65 -33.2 73.59 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-O 120.794 0.331 . . . . 0.0 110.635 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 27.5 t -75.64 -41.7 53.45 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.845 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 18.9 t60 70.78 -67.0 0.27 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.442 1.497 . . . . 0.0 111.211 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 6.4 p -106.35 105.83 16.05 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-O 121.267 0.555 . . . . 0.0 110.19 -179.094 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -73.81 -176.5 2.45 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.563 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 169.27 -48.02 0.21 Allowed Glycine 0 N--CA 1.432 -1.604 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 98.92 -173.06 26.32 Favored Glycine 0 N--CA 1.435 -1.428 0 N-CA-C 110.333 -1.107 . . . . 0.0 110.333 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 164.96 143.09 3.6 Favored Glycine 0 N--CA 1.432 -1.598 0 C-N-CA 120.182 -1.008 . . . . 0.0 112.387 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 32.3 t -85.45 119.14 25.48 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -88.43 -111.29 1.12 Allowed Glycine 0 N--CA 1.437 -1.241 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.378 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -121.94 -102.43 1.73 Allowed Glycine 0 C--N 1.302 -1.351 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 100.76 84.62 1.81 Allowed Glycine 0 N--CA 1.434 -1.489 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.476 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 22.6 m -83.82 166.07 18.26 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 176.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 133' ' ' GLY . . . . . 0.414 ' HA2' ' HB3' ' A' ' 13' ' ' ASP . . . 169.23 163.59 23.52 Favored Glycine 0 N--CA 1.432 -1.626 0 C-N-CA 120.044 -1.074 . . . . 0.0 112.2 -178.15 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 129.04 25.96 0.94 Allowed Glycine 0 C--N 1.303 -1.302 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 177.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -106.97 -37.45 2.35 Favored Glycine 0 N--CA 1.422 -2.241 0 C-N-CA 120.868 -0.682 . . . . 0.0 113.081 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 36.6 t -140.09 -67.37 0.43 Allowed 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 -176.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 61.9 mt -105.72 -24.64 12.48 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 121.359 0.599 . . . . 0.0 110.402 -172.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.5 ' HA ' ' SD ' ' B' ' 141' ' ' MET . 1.1 mp0 -66.67 -19.32 65.74 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.95 -176.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 32.7 m -49.91 -47.49 52.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.703 1.601 . . . . 0.0 112.448 -177.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -136.3 74.99 1.52 Allowed 'General case' 0 CA--C 1.487 -1.478 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 174.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.5 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 5.0 ttt -103.32 -29.24 11.37 Favored 'General case' 0 C--O 1.168 -3.204 0 N-CA-C 114.52 1.304 . . . . 0.0 114.52 -168.098 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.481 ' CD ' ' H ' ' B' ' 142' ' ' GLU . 1.6 mp0 -30.14 -65.61 0.11 Allowed 'General case' 0 N--CA 1.503 2.176 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 -170.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 9.1 p -68.7 -37.97 79.94 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.407 0.622 . . . . 0.0 111.017 -177.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 42.7 mm -64.39 -48.05 86.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.94 -179.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.4 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 10.0 tp -65.6 -42.04 92.02 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.443 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.356 -176.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -62.78 -56.35 18.31 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 119.018 -1.073 . . . . 0.0 111.028 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 25.5 t -62.66 -50.93 69.24 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.519 -173.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -80.67 -37.02 31.58 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -174.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.585 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 2.3 tm? -77.74 -51.92 9.77 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 118.444 -0.788 . . . . 0.0 111.699 -175.1 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.638 ' HA ' ' CD2' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -172.99 129.99 0.49 Allowed 'General case' 0 C--N 1.366 1.311 0 C-N-CA 118.918 -1.113 . . . . 0.0 113.784 179.732 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -90.72 99.43 12.46 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 107.91 -1.145 . . . . 0.0 107.91 172.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.588 0 CA-C-N 114.197 -1.365 . . . . 0.0 107.401 -176.409 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.323 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.0 t -71.19 110.91 4.5 Favored 'Isoleucine or valine' 0 C--O 1.254 1.294 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.456 ' H ' ' HD2' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -89.18 113.92 25.17 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 178.339 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -106.63 117.9 35.25 Favored 'General case' 0 C--N 1.274 -2.707 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -174.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.21 -20.76 44.66 Favored Glycine 0 C--N 1.313 -0.721 0 O-C-N 124.045 0.841 . . . . 0.0 114.533 -174.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -69.58 -8.97 51.96 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 178.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.01 -20.4 66.48 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -80.85 -8.54 59.74 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.265 0.555 . . . . 0.0 110.431 178.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -103.54 5.15 36.52 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 121.464 0.649 . . . . 0.0 111.198 -176.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.8 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.9 OUTLIER -122.13 120.43 61.3 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.714 0 N-CA-C 105.132 -2.173 . . . . 0.0 105.132 175.747 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.5 m -74.6 149.7 39.96 Favored 'General case' 0 N--CA 1.407 -2.591 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.1 tm0? -61.27 -38.18 85.83 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.07 -30.72 71.29 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.29 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.468 ' O ' HD13 ' A' ' 18' ' ' LEU . 2.7 tm? -75.45 -53.68 8.28 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.523 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.2 ptm180 -56.44 -44.99 81.01 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 176.458 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.4 t -69.37 -25.86 64.38 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 121.291 -0.163 . . . . 0.0 110.912 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.471 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 30.6 t60 -70.38 -37.11 74.48 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.623 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.602 HD23 HD21 ' A' ' 68' ' ' LEU . 1.7 mp -66.13 -42.72 88.74 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.49 175.09 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.9 t -55.83 -50.72 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.896 0.878 . . . . 0.0 109.878 174.587 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -52.51 -47.15 66.82 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.738 176.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.471 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 61.4 mttm -66.98 -40.15 87.35 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.76 178.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.493 ' O ' HG22 ' A' ' 26' ' ' ILE . 64.9 mt -51.8 -51.06 59.2 Favored 'General case' 0 CA--C 1.506 -0.73 0 O-C-N 123.901 0.751 . . . . 0.0 110.252 175.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.645 HG11 ' HE1' ' A' ' 40' ' ' MET . 78.1 t -54.55 -53.14 33.87 Favored 'Isoleucine or valine' 0 C--O 1.186 -2.283 0 O-C-N 124.164 0.915 . . . . 0.0 110.258 176.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.418 ' HB3' ' HA2' ' B' ' 127' ' ' GLY . 22.8 mm-40 -53.74 -36.41 62.29 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -176.545 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.48 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.79 -45.71 15.22 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 177.276 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.523 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.77 -26.37 16.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.832 0.825 . . . . 0.0 110.49 -174.698 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.523 ' CD2' HG23 ' A' ' 26' ' ' ILE . 50.6 m-85 -130.69 93.52 31.51 Favored Pre-proline 0 C--N 1.285 -2.23 0 C-N-CA 124.187 0.995 . . . . 0.0 109.877 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.438 ' CG ' ' HA ' ' B' ' 118' ' ' ASP . 35.9 Cg_endo -65.88 109.01 1.39 Allowed 'Trans proline' 0 C--O 1.249 1.027 0 C-N-CA 121.7 1.6 . . . . 0.0 109.904 176.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.4 t -76.07 140.14 69.71 Favored Pre-proline 0 N--CA 1.43 -1.426 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.196 -174.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -72.21 -36.2 5.89 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.336 2.024 . . . . 0.0 111.101 176.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -146.97 146.3 25.48 Favored Pre-proline 0 C--N 1.313 -1.001 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 -176.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.41 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 9.9 Cg_endo -55.39 -24.11 41.59 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 122.413 2.076 . . . . 0.0 114.132 175.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.47 -11.49 59.85 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.082 -1.011 . . . . 0.0 111.856 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.0 -9.15 58.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.665 0.745 . . . . 0.0 109.557 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 40' ' ' MET . 18.1 mt -90.15 -5.55 56.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.085 -0.962 . . . . 0.0 110.39 -178.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -133.81 33.16 3.47 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.648 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 32.5 t70 -112.13 176.59 4.96 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 113.76 -1.564 . . . . 0.0 110.65 -173.095 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.648 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.28 -25.59 62.51 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-O 121.196 0.522 . . . . 0.0 110.635 176.89 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.554 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 5.2 tpm_? -71.15 -30.83 66.94 Favored 'General case' 0 C--O 1.252 1.219 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 176.337 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.814 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.5 tpp -58.25 -39.91 80.39 Favored 'General case' 0 C--O 1.197 -1.66 0 CA-C-N 114.483 -1.235 . . . . 0.0 112.683 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.9 pt-20 -59.05 -30.38 68.01 Favored 'General case' 0 C--O 1.205 -1.281 0 C-N-CA 119.521 -0.871 . . . . 0.0 110.919 -177.801 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -74.77 -46.18 38.77 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.287 0.565 . . . . 0.0 109.902 176.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.2 mt -60.2 -51.14 70.86 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.715 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.814 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -71.88 -27.88 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.646 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.376 -178.315 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.49 -46.68 86.19 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.523 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 7.5 t80 -59.76 -47.1 87.02 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.4 174.268 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.49 97.83 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 120.369 -0.533 . . . . 0.0 111.306 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -65.14 -45.81 83.49 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.206 0.602 . . . . 0.0 111.34 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.523 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 56.5 pttt -63.71 -38.04 89.63 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-O 121.726 0.774 . . . . 0.0 110.321 -178.312 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.494 HG21 ' CE1' ' A' ' 46' ' ' TYR . 39.9 t -73.82 -42.84 53.9 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.225 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.134 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.429 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 15.0 tm-20 -58.6 -44.4 89.88 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.55 -43.51 97.55 Favored Glycine 0 CA--C 1.501 -0.783 0 O-C-N 123.626 0.579 . . . . 0.0 111.949 177.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -55.48 -54.36 44.79 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 123.025 0.53 . . . . 0.0 111.718 177.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.48 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -70.76 -29.77 66.09 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -64.64 -49.84 69.43 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 177.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -76.33 -14.23 60.11 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.22 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.1 t -86.77 -17.72 32.84 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.848 0.356 . . . . 0.0 110.106 176.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.43 171.81 8.16 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-O 121.225 0.536 . . . . 0.0 112.045 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -124.02 14.6 9.18 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.723 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 82.5 p -167.9 156.59 9.29 Favored 'General case' 0 CA--C 1.486 -1.505 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 175.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.8 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -67.36 -31.32 71.49 Favored 'General case' 0 C--O 1.189 -2.128 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.625 175.03 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -58.78 -47.88 83.18 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 123.725 0.641 . . . . 0.0 110.499 178.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -65.96 -45.12 82.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.57 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.421 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -66.11 -46.46 77.51 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.856 -176.463 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -60.62 -44.29 96.5 Favored 'General case' 0 C--O 1.204 -1.323 0 C-N-CA 123.831 0.852 . . . . 0.0 109.283 177.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.471 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 7.4 t60 -58.88 -57.32 13.58 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 123.261 0.624 . . . . 0.0 110.925 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.476 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.2 pp -68.03 -33.21 74.16 Favored 'General case' 0 C--O 1.258 1.537 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -173.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.602 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -72.34 -37.78 68.78 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 179.573 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.597 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -60.39 -40.11 89.72 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.552 176.414 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 55.7 mm-40 -60.78 -46.11 91.75 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.01 178.466 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -42.5 75.3 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 118.769 -1.172 . . . . 0.0 111.23 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.518 HG22 ' HA ' ' A' ' 69' ' ' ALA . 5.5 tt -63.13 -42.26 95.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.751 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -57.19 -52.97 63.18 Favored 'General case' 0 C--O 1.274 2.366 0 C-N-CA 125.054 1.342 . . . . 0.0 110.379 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.6 -32.06 73.44 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.571 -178.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.48 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -68.1 -37.12 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 123.007 0.523 . . . . 0.0 111.11 178.206 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.565 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 34.9 mt-30 -65.59 -45.67 82.3 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 121.189 0.519 . . . . 0.0 110.751 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.541 ' HB3' ' HZ3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -70.32 -27.88 64.72 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 118.472 -1.291 . . . . 0.0 113.034 175.605 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -63.44 -48.42 77.81 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 175.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.6 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.7 pp -62.9 -40.46 97.64 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.06 -178.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.433 ' N ' HD12 ' A' ' 79' ' ' LEU . 0.7 OUTLIER -60.39 -53.33 58.9 Favored 'General case' 0 N--CA 1.412 -2.344 0 O-C-N 123.956 0.785 . . . . 0.0 110.467 -179.61 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -72.35 -33.17 67.09 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 118.982 -1.087 . . . . 0.0 112.54 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.426 ' HE3' ' CG ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -67.21 -34.14 76.87 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.396 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -77.98 -40.54 38.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.713 178.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 -87.41 -57.94 2.77 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -171.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 66.4 m -155.28 98.9 2.03 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.471 ' HG3' ' HG ' ' A' ' 87' ' ' LEU . 4.5 ptp180 176.15 -31.66 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.071 0 C-N-CA 126.639 1.975 . . . . 0.0 109.313 170.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.471 ' HG ' ' HG3' ' A' ' 86' ' ' ARG . 36.2 mt . . . . . 0 C--O 1.243 0.738 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.448 -177.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.679 0 CA-C-O 121.881 0.712 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 20.3 m -132.64 90.71 2.81 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-O 121.116 0.484 . . . . 0.0 110.273 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 25.2 mmt -120.85 -30.42 4.43 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.886 177.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 19.8 m -85.09 -43.88 13.5 Favored 'General case' 0 N--CA 1.435 -1.224 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.777 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -97.65 89.3 4.6 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-O 122.323 1.058 . . . . 0.0 108.272 174.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 106' ' ' TYR . . . . . 0.456 ' HA ' ' CG ' ' B' ' 109' ' ' GLN . 84.8 m-85 72.62 165.92 0.3 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 113.557 -1.656 . . . . 0.0 111.25 -172.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 95.44 -83.73 0.89 Allowed Glycine 0 C--N 1.304 -1.226 0 N-CA-C 110.657 -0.977 . . . . 0.0 110.657 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 108' ' ' ASN . . . . . 0.408 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 14.2 m120 -96.37 62.92 2.11 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 177.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.456 ' CG ' ' HA ' ' B' ' 106' ' ' TYR . 23.9 mm-40 -82.4 -35.7 27.44 Favored 'General case' 0 CA--C 1.481 -1.687 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.374 -178.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 19.3 p -61.08 -36.53 79.89 Favored 'General case' 0 C--O 1.2 -1.536 0 O-C-N 123.969 0.793 . . . . 0.0 110.269 178.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 61.1 tp -58.73 -43.83 90.29 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 122.951 0.5 . . . . 0.0 110.733 176.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 47.1 mm-40 -66.54 -50.63 62.54 Favored 'General case' 0 C--O 1.252 1.22 0 CA-C-O 121.417 0.627 . . . . 0.0 109.358 -177.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -60.89 -48.18 83.01 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.723 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.6 HD21 ' HB3' ' A' ' 79' ' ' LEU . 36.9 tp -69.65 -20.51 63.58 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.908 -176.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.0 tp -74.89 -44.36 49.27 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 173.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.484 ' O ' ' HB3' ' B' ' 119' ' ' SER . 42.2 m -68.9 -36.68 78.33 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 114.506 -1.224 . . . . 0.0 111.062 -179.347 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.546 ' OG ' ' HA ' ' B' ' 114' ' ' LEU . 68.2 p -75.95 -34.98 59.85 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.011 0.434 . . . . 0.0 110.108 178.212 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 20.6 t70 -59.01 -36.58 75.18 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.597 0.713 . . . . 0.0 109.409 175.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 119' ' ' SER . . . . . 0.484 ' HB3' ' O ' ' B' ' 116' ' ' THR . 38.1 t -57.83 -11.04 1.97 Allowed 'General case' 0 CA--C 1.561 1.375 0 CA-C-N 114.009 -1.451 . . . . 0.0 112.581 178.465 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 67.4 tp -62.74 -62.42 1.75 Allowed 'General case' 0 C--N 1.347 0.477 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 174.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 33.5 t -77.26 -28.09 53.4 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 29.2 t60 84.96 -57.7 0.09 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 126.644 1.977 . . . . 0.0 109.674 -177.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 19.0 p -169.81 75.87 0.09 Allowed 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 176.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -176.64 145.22 0.53 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.715 0.406 . . . . 0.0 110.094 174.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 88.42 -123.52 6.79 Favored Glycine 0 N--CA 1.429 -1.814 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -179.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 126.26 -125.89 5.6 Favored Glycine 0 N--CA 1.427 -1.943 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.676 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 127' ' ' GLY . . . . . 0.418 ' HA2' ' HB3' ' A' ' 24' ' ' GLN . . . -101.55 -154.15 26.07 Favored Glycine 0 N--CA 1.427 -1.924 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.12 -179.067 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 33.0 t -156.21 137.72 14.04 Favored 'General case' 0 N--CA 1.429 -1.524 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -90.45 -169.5 43.09 Favored Glycine 0 N--CA 1.432 -1.579 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.412 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 78.9 178.9 51.2 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.245 177.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -155.54 153.19 24.58 Favored Glycine 0 N--CA 1.438 -1.231 0 N-CA-C 108.624 -1.791 . . . . 0.0 108.624 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 46.9 m -141.33 138.01 32.8 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 117.987 0.894 . . . . 0.0 110.534 -177.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 142.72 174.44 15.12 Favored Glycine 0 N--CA 1.43 -1.701 0 C-N-CA 120.922 -0.656 . . . . 0.0 113.044 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -152.33 135.67 5.07 Favored Glycine 0 N--CA 1.438 -1.19 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 176.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 142.68 -129.08 3.68 Favored Glycine 0 N--CA 1.435 -1.401 0 C-N-CA 120.204 -0.998 . . . . 0.0 112.512 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 2.7 p -62.42 -70.82 0.18 Allowed 'General case' 0 CA--C 1.556 1.195 0 N-CA-C 115.456 1.65 . . . . 0.0 115.456 -174.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 65.7 mt -106.26 -27.73 10.85 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 122.069 0.938 . . . . 0.0 109.078 -177.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -73.45 -12.0 60.65 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.146 -1.388 . . . . 0.0 114.051 -175.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 6.9 p -55.44 -60.46 3.39 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -178.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -120.99 85.11 2.34 Favored 'General case' 0 CA--C 1.477 -1.841 0 N-CA-C 104.325 -2.472 . . . . 0.0 104.325 173.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.485 ' O ' HG12 ' B' ' 145' ' ' ILE . 19.4 ttt -93.45 -38.79 11.25 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 114.189 -1.369 . . . . 0.0 112.66 -164.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 41.3 mt-10 -55.61 -42.25 74.62 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -174.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.4 p -59.26 -51.65 69.06 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.36 0.6 . . . . 0.0 110.722 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 41.1 mt -67.3 -47.54 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.686 -177.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.485 HG12 ' O ' ' B' ' 141' ' ' MET . 40.4 pt -66.32 -31.19 52.5 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.141 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 146' ' ' ARG . . . . . 0.535 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 91.2 mtt180 -68.97 -53.15 22.3 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 118.423 -1.311 . . . . 0.0 108.883 177.014 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 47.6 t -60.67 -54.96 38.92 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.403 -177.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -82.4 -41.49 19.85 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 -178.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.597 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 9.4 tt -97.59 -34.29 11.02 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -166.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 22.7 ptt? -169.36 127.82 0.98 Allowed 'General case' 0 C--O 1.242 0.671 0 CA-C-O 123.24 1.495 . . . . 0.0 114.203 -176.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -107.8 -59.82 1.79 Allowed 'General case' 0 C--N 1.271 -2.841 0 CA-C-N 112.539 -2.118 . . . . 0.0 108.325 -177.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.66 0 N-CA-C 101.366 -3.568 . . . . 0.0 101.366 -179.843 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.094 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.7 m -89.84 104.54 15.23 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 122.452 1.12 . . . . 0.0 113.019 -178.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.505 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -109.25 93.76 4.68 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.544 177.835 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.433 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 9.9 ptpt -143.41 103.62 4.13 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.906 -1.497 . . . . 0.0 109.999 -174.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.57 -20.16 1.55 Allowed Glycine 0 N--CA 1.484 1.85 0 N-CA-C 117.121 1.608 . . . . 0.0 117.121 -170.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.433 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 67.2 p-90 -67.84 -16.51 64.13 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 117.462 0.631 . . . . 0.0 111.798 179.074 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -67.72 -9.91 47.86 Favored 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -89.47 -8.05 53.72 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.417 0.627 . . . . 0.0 109.663 176.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -100.04 3.08 43.92 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.634 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.0 p -135.27 113.82 15.97 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.997 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 -177.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 m -96.28 163.75 12.95 Favored 'General case' 0 N--CA 1.419 -2.01 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -176.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.8 tm0? -51.16 -36.43 40.95 Favored 'General case' 0 C--O 1.213 -0.827 0 C-N-CA 124.325 1.05 . . . . 0.0 111.498 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -55.42 -44.81 76.59 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 123.257 0.623 . . . . 0.0 111.807 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.49 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.0 tm? -70.23 -51.14 33.03 Favored 'General case' 0 CA--C 1.492 -1.281 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -175.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.551 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.6 ptm180 -65.52 -40.99 93.59 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 114.505 -1.225 . . . . 0.0 113.091 -175.515 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.2 t -68.18 -28.33 67.18 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -66.5 -43.0 86.53 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.78 HD23 HD21 ' A' ' 68' ' ' LEU . 5.1 mp -67.38 -40.61 85.7 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.033 177.011 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 15' ' ' ARG . 65.2 t -57.6 -49.21 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.7 0.8 . . . . 0.0 110.095 175.089 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -54.49 -45.1 73.17 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.309 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.4 mttm -68.55 -38.32 80.68 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.315 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.475 ' O ' HG22 ' A' ' 26' ' ' ILE . 65.8 mt -54.07 -46.58 72.05 Favored 'General case' 0 C--O 1.214 -0.787 0 O-C-N 123.661 0.601 . . . . 0.0 109.589 174.577 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.664 HG11 ' HE1' ' A' ' 40' ' ' MET . 46.8 t -55.28 -53.43 35.29 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.559 0 O-C-N 124.003 0.815 . . . . 0.0 110.833 174.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -57.32 -30.69 64.99 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.499 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -82.77 -46.91 12.54 Favored 'General case' 0 C--O 1.203 -1.372 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 174.535 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.481 HG13 ' CE1' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -73.32 -26.57 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 121.799 0.809 . . . . 0.0 110.068 -174.819 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -131.53 91.89 33.11 Favored Pre-proline 0 N--CA 1.405 -2.721 0 C-N-CA 124.438 1.095 . . . . 0.0 108.594 176.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -63.64 93.3 0.17 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.725 1.617 . . . . 0.0 109.202 176.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.415 HG21 HD21 ' A' ' 35' ' ' LEU . 4.8 t -65.82 130.05 94.41 Favored Pre-proline 0 N--CA 1.415 -2.18 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.567 -172.42 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.477 ' HG2' ' OD1' ' A' ' 31' ' ' ASP . 41.8 Cg_endo -73.64 -31.63 8.46 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.588 2.192 . . . . 0.0 111.085 178.547 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.477 ' OD1' ' HG2' ' A' ' 30' ' ' PRO . 6.3 p-10 -144.18 155.4 58.24 Favored Pre-proline 0 N--CA 1.427 -1.622 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.429 -175.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.53 ' HA ' HD12 ' A' ' 35' ' ' LEU . 72.5 Cg_endo -75.66 -5.23 16.26 Favored 'Trans proline' 0 N--CA 1.45 -1.068 0 C-N-CA 121.77 1.647 . . . . 0.0 113.351 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -88.54 -24.68 22.84 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.542 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.93 -21.09 63.07 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 122.038 0.923 . . . . 0.0 109.831 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.53 HD12 ' HA ' ' A' ' 32' ' ' PRO . 45.2 mt -80.05 -8.44 59.37 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.24 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -134.2 21.93 3.76 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.215 0.531 . . . . 0.0 109.927 178.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.412 ' O ' ' HB3' ' A' ' 40' ' ' MET . 20.5 t70 -90.11 178.02 6.29 Favored 'General case' 0 N--CA 1.422 -1.862 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.774 ' HD2' ' N ' ' A' ' 39' ' ' ARG . 2.3 ppt_? -63.75 -28.9 70.2 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.774 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 4.5 tpm_? -70.18 -30.19 67.25 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.032 -175.271 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.726 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 6.7 tpp -57.72 -32.17 67.15 Favored 'General case' 0 C--O 1.201 -1.452 0 CA-C-N 114.231 -1.35 . . . . 0.0 112.086 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -61.42 -29.83 70.18 Favored 'General case' 0 C--O 1.18 -2.594 0 C-N-CA 118.111 -1.436 . . . . 0.0 110.918 -179.445 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -75.48 -46.66 31.14 Favored 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 124.024 0.828 . . . . 0.0 109.088 176.032 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 39' ' ' ARG . 5.2 mp -51.63 -56.94 10.72 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 114.299 -1.319 . . . . 0.0 109.894 179.275 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.726 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -73.29 -28.2 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.59 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.517 -177.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -61.53 -43.24 99.22 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.499 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.546 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.9 t80 -65.81 -47.08 76.26 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.61 174.352 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.44 -40.91 88.32 Favored 'General case' 0 C--O 1.2 -1.51 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.829 -176.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.7 -43.07 80.94 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.612 0.765 . . . . 0.0 111.997 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.546 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 57.0 pttt -67.04 -40.25 87.12 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.399 0.619 . . . . 0.0 109.708 -178.089 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.448 HG21 ' CE2' ' A' ' 46' ' ' TYR . 45.7 t -71.53 -47.26 59.23 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.668 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -57.73 -45.65 85.52 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.91 -44.39 94.45 Favored Glycine 0 N--CA 1.436 -1.349 0 O-C-N 124.236 0.96 . . . . 0.0 111.768 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -58.72 -54.19 49.86 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.478 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -65.26 -35.21 80.31 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 178.768 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -62.91 -50.88 69.1 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.644 0.735 . . . . 0.0 109.34 177.411 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.78 -21.75 61.68 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.163 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.7 t -85.28 -42.8 14.3 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -178.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.05 163.52 14.63 Favored 'General case' 0 C--O 1.244 0.797 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -109.05 2.82 21.46 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.583 -178.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.419 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 48.7 m -161.44 154.29 20.69 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 176.104 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.58 -34.53 74.28 Favored 'General case' 0 C--O 1.196 -1.757 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.184 -178.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.419 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 4.9 p-10 -65.12 -35.83 82.36 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -66.82 -47.84 70.78 Favored 'General case' 0 N--CA 1.455 -0.175 0 O-C-N 123.487 0.492 . . . . 0.0 110.564 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -45.1 89.94 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.252 -177.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -60.65 -46.01 91.92 Favored 'General case' 0 C--O 1.19 -2.063 0 O-C-N 123.978 0.799 . . . . 0.0 109.719 176.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.555 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 28.7 t-80 -60.05 -55.05 38.7 Favored 'General case' 0 C--O 1.208 -1.104 0 O-C-N 123.194 0.309 . . . . 0.0 111.581 -178.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.455 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.1 pp -65.74 -32.55 74.16 Favored 'General case' 0 C--O 1.262 1.746 0 CA-C-O 120.965 0.412 . . . . 0.0 111.47 -175.573 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.78 HD21 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -75.09 -35.83 61.75 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.362 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.633 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.11 -34.84 78.47 Favored 'General case' 0 C--O 1.203 -1.347 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.736 176.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.555 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 17.2 mt-10 -69.43 -42.53 74.86 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.467 178.255 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.9 -38.82 83.47 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.393 -0.923 . . . . 0.0 110.891 179.231 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.633 HG22 ' HA ' ' A' ' 69' ' ' ALA . 5.9 tt -66.2 -48.37 81.48 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.853 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.548 177.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.454 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 8.3 t80 -51.71 -51.39 56.4 Favored 'General case' 0 C--O 1.269 2.116 0 C-N-CA 124.949 1.3 . . . . 0.0 111.837 178.183 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.8 ptpt -65.03 -38.8 92.06 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.884 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.487 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -64.42 -37.06 79.03 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.654 0 O-C-N 123.557 0.536 . . . . 0.0 111.124 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.663 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.2 mm-40 -59.65 -55.38 35.17 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 122.085 0.945 . . . . 0.0 109.454 178.479 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 1.2 ptpm? -70.19 -27.66 64.68 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.572 178.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.528 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 6.3 tp10 -63.67 -45.84 88.28 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 176.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.7 pp -64.79 -44.83 88.7 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.874 -177.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.464 ' N ' HD12 ' A' ' 79' ' ' LEU . 7.1 pt-20 -68.67 -44.63 73.65 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 119.364 -0.934 . . . . 0.0 112.65 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.6 -40.06 95.73 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.421 -0.511 . . . . 0.0 110.813 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.66 -29.83 62.56 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.403 -178.427 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -76.82 -42.66 39.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.035 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -90.12 -59.14 2.27 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.349 -0.54 . . . . 0.0 112.396 -173.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.8 t -175.71 105.23 0.08 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 120.955 0.407 . . . . 0.0 110.443 -174.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.498 ' HG3' HD12 ' A' ' 87' ' ' LEU . 14.3 ptm180 -121.76 -24.47 5.26 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 173.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.498 HD12 ' HG3' ' A' ' 86' ' ' ARG . 6.6 mp . . . . . 0 C--O 1.244 0.785 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 176.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 101' ' ' GLY . . . . . 0.459 ' N ' ' HG ' ' B' ' 104' ' ' SER . . . . . . . . 0 C--O 1.243 0.673 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 7.8 p -61.12 -41.53 96.88 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.537 0.684 . . . . 0.0 111.029 -178.133 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 22.0 ptm -71.5 -6.43 40.45 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.36 -0.837 . . . . 0.0 112.073 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 104' ' ' SER . . . . . 0.459 ' HG ' ' N ' ' B' ' 101' ' ' GLY . 5.4 m -105.32 -53.51 2.64 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 36.2 m80 -87.57 -12.81 44.63 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.727 -173.193 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 106' ' ' TYR . . . . . 0.445 ' HA ' HE21 ' B' ' 109' ' ' GLN . 16.9 t80 -137.48 20.75 2.93 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 122.212 1.005 . . . . 0.0 108.828 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -139.45 74.2 0.39 Allowed Glycine 0 N--CA 1.436 -1.345 0 N-CA-C 110.093 -1.203 . . . . 0.0 110.093 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 63.65 76.9 0.34 Allowed 'General case' 0 C--O 1.245 0.841 0 C-N-CA 124.273 1.029 . . . . 0.0 109.266 -174.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.445 HE21 ' HA ' ' B' ' 106' ' ' TYR . 18.9 mp0 -62.81 -50.93 69.05 Favored 'General case' 0 CA--C 1.505 -0.78 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.003 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 5.2 t -68.11 -35.23 77.8 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -168.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 58.8 tp -69.51 -41.67 75.72 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.269 0.941 . . . . 0.0 110.763 -178.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -75.52 -34.02 60.77 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.539 -177.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -64.66 -46.83 80.81 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.86 0.838 . . . . 0.0 109.266 174.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.612 HD21 ' HB3' ' A' ' 79' ' ' LEU . 47.7 tp -65.55 -28.47 69.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.128 179.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 46.4 tp -69.58 -37.72 77.09 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 18.2 m -63.56 -41.35 98.41 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 14.3 m -63.94 -46.67 83.69 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.417 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -61.27 -29.58 69.94 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 125.117 1.367 . . . . 0.0 111.135 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 8.9 t -67.53 -28.82 68.13 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.107 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 9.9 tt -83.17 -24.01 32.66 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 123.096 0.558 . . . . 0.0 110.209 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 19.6 m -62.16 -36.32 81.48 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.821 -179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 68.56 -63.07 0.36 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.054 0.942 . . . . 0.0 111.134 -178.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 14.5 m -98.02 172.08 7.85 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.28 99.43 1.18 Allowed 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -90.06 175.2 41.29 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.195 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 172.72 -161.06 32.33 Favored Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -170.25 156.99 28.04 Favored Glycine 0 N--CA 1.434 -1.443 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 50.0 m -139.21 173.79 11.18 Favored 'General case' 0 C--N 1.29 -1.992 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 179.21 179.72 48.76 Favored Glycine 0 N--CA 1.429 -1.785 0 C-N-CA 120.14 -1.029 . . . . 0.0 111.978 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 104.1 135.85 8.66 Favored Glycine 0 N--CA 1.431 -1.691 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -108.96 -140.29 8.97 Favored Glycine 0 N--CA 1.421 -2.313 0 N-CA-C 109.079 -1.609 . . . . 0.0 109.079 176.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.0 t -140.03 75.98 1.54 Allowed 'General case' 0 N--CA 1.418 -2.039 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 173.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -165.27 51.86 0.27 Allowed Glycine 0 N--CA 1.429 -1.783 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 176.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -61.02 87.99 0.03 OUTLIER Glycine 0 C--O 1.241 0.567 0 O-C-N 124.644 0.85 . . . . 0.0 113.872 -176.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 179.92 131.13 1.59 Allowed Glycine 0 N--CA 1.416 -2.648 0 N-CA-C 108.212 -1.955 . . . . 0.0 108.212 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 34.2 m 71.1 108.79 0.06 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.629 0.772 . . . . 0.0 110.48 -176.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.454 ' HA ' ' CG ' ' B' ' 141' ' ' MET . 1.8 pt? -40.67 -49.44 3.04 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.215 1.806 . . . . 0.0 114.965 -174.137 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.45 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 6.3 pt-20 -82.76 -12.83 57.23 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -177.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 46.4 t -83.81 -61.49 1.81 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 140' ' ' ASP . . . . . 0.408 ' OD2' ' HB2' ' B' ' 142' ' ' GLU . 33.2 t70 -173.12 130.76 0.48 Allowed 'General case' 0 CA--C 1.492 -1.259 0 C-N-CA 123.834 0.854 . . . . 0.0 108.886 176.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.587 ' HB2' ' HB ' ' B' ' 145' ' ' ILE . 64.0 mtm -103.36 -8.4 20.28 Favored 'General case' 0 C--N 1.28 -2.448 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -177.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.408 ' HB2' ' OD2' ' B' ' 140' ' ' ASP . 0.5 OUTLIER 29.4 -86.54 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 127.684 2.394 . . . . 0.0 114.432 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.53 -46.95 62.64 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.966 -172.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 47.3 mm -64.42 -47.97 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-N 114.161 -1.381 . . . . 0.0 109.167 -177.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.587 ' HB ' ' HB2' ' B' ' 141' ' ' MET . 15.6 tt -70.01 -31.57 48.26 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.403 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.616 -176.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 27.6 ttm-85 -64.73 -60.6 2.92 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 19.3 p -66.78 -44.04 82.37 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -174.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -80.57 -38.83 28.79 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.478 ' HA ' ' HB1' ' A' ' 69' ' ' ALA 0.267 9.1 tt -91.17 -42.63 10.34 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -173.431 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -159.95 123.2 3.55 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 117.818 -1.553 . . . . 0.0 114.116 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -119.96 118.46 30.75 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 114.369 -1.287 . . . . 0.0 109.326 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.288 -2.079 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 178.074 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.483 -1.959 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 93.4 t 69.18 121.32 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.795 0 CA-C-O 121.889 0.852 . . . . 0.0 110.52 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.429 ' HD2' ' HA ' ' A' ' 3' ' ' ARG . 1.5 tpt180 -83.58 111.48 19.14 Favored 'General case' 0 N--CA 1.408 -2.57 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.096 -172.275 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.421 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 42.3 mttp -115.58 108.62 16.66 Favored 'General case' 0 N--CA 1.42 -1.975 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 178.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.461 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -67.03 -3.92 25.56 Favored Glycine 0 C--N 1.31 -0.889 0 CA-C-N 115.838 -0.619 . . . . 0.0 114.263 -174.166 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.421 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 61.1 p-90 -78.76 -11.84 60.0 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 122.275 -0.544 . . . . 0.0 111.108 177.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -59.07 -26.56 64.73 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-O 121.267 0.556 . . . . 0.0 111.233 -178.276 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 12.9 pt-20 -81.89 -4.11 55.77 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -176.113 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -104.52 2.78 31.24 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 120.973 0.416 . . . . 0.0 111.555 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.755 HG22 ' HB3' ' A' ' 61' ' ' ARG . 1.5 t -110.5 110.54 32.55 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.459 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.497 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER -68.9 151.55 46.42 Favored 'General case' 0 N--CA 1.412 -2.373 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -179.15 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -55.03 -41.65 71.62 Favored 'General case' 0 N--CA 1.426 -1.627 0 O-C-N 124.672 1.232 . . . . 0.0 108.796 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.487 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 10.9 m-20 -67.45 -30.52 70.28 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-O 118.866 -0.587 . . . . 0.0 112.534 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.531 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.68 -54.65 7.62 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' A' ' 11' ' ' THR . 1.6 ptm180 -55.14 -48.2 74.02 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 177.027 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.417 ' HA ' ' HB ' ' A' ' 19' ' ' VAL . 40.0 m -72.61 -21.13 61.17 Favored 'General case' 0 N--CA 1.426 -1.664 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.249 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.487 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 10.5 t60 -67.89 -42.43 81.22 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 174.367 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.71 HD23 HD21 ' A' ' 68' ' ' LEU . 3.9 mp -69.84 -40.08 76.05 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.794 178.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.2 t -55.8 -49.72 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 C-N-CA 123.559 0.744 . . . . 0.0 109.942 172.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -53.15 -50.38 64.66 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.264 1.026 . . . . 0.0 110.122 178.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -66.73 -38.14 86.08 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.046 179.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.493 ' O ' HG22 ' A' ' 26' ' ' ILE . 3.2 mt -51.02 -50.79 57.87 Favored 'General case' 0 CA--C 1.495 -1.152 0 O-C-N 123.924 0.765 . . . . 0.0 109.61 174.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.626 HG11 ' HE1' ' A' ' 40' ' ' MET . 57.8 t -55.56 -52.78 43.56 Favored 'Isoleucine or valine' 0 C--O 1.172 -2.999 0 O-C-N 124.336 1.023 . . . . 0.0 109.771 175.155 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -54.09 -33.29 57.21 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -175.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.549 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -82.01 -46.23 14.24 Favored 'General case' 0 C--O 1.207 -1.175 0 CA-C-O 121.505 0.669 . . . . 0.0 111.597 175.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.579 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -78.55 -23.69 13.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 CA-C-O 122.065 0.936 . . . . 0.0 110.84 -174.082 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.579 ' CD2' HG23 ' A' ' 26' ' ' ILE . 66.1 m-85 -135.31 95.26 14.86 Favored Pre-proline 0 C--N 1.279 -2.47 0 C-N-CA 125.057 1.343 . . . . 0.0 107.491 178.27 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -60.53 95.29 0.11 Allowed 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.287 1.992 . . . . 0.0 112.47 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.448 HG21 HD21 ' A' ' 35' ' ' LEU . 10.0 t -75.27 124.62 89.29 Favored Pre-proline 0 N--CA 1.424 -1.74 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.058 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.39 -29.36 13.85 Favored 'Trans proline' 0 C--O 1.245 0.869 0 C-N-CA 122.402 2.068 . . . . 0.0 111.752 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -141.54 151.72 61.39 Favored Pre-proline 0 CA--C 1.486 -1.496 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -176.382 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.496 ' HA ' HD12 ' A' ' 35' ' ' LEU . 38.1 Cg_endo -71.67 -7.35 21.0 Favored 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 121.587 1.525 . . . . 0.0 111.611 175.072 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.9 -12.9 43.39 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-O 121.318 0.58 . . . . 0.0 110.69 177.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.53 -6.09 54.48 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 122.159 0.98 . . . . 0.0 108.722 175.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.566 ' O ' ' HG2' ' A' ' 40' ' ' MET . 27.6 mt -91.75 6.53 45.59 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.797 -179.199 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -133.07 21.91 4.12 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.619 ' OD1' ' HD3' ' A' ' 38' ' ' ARG . 13.9 t70 -85.16 170.26 13.06 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.695 -1.593 . . . . 0.0 108.449 -178.121 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.619 ' HD3' ' OD1' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.63 -24.74 61.93 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.939 0.876 . . . . 0.0 110.567 178.747 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.618 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 40.3 ttp180 -75.02 -21.2 59.23 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.818 -1.083 . . . . 0.0 109.109 178.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.768 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.2 tpp -60.67 -34.26 74.05 Favored 'General case' 0 C--O 1.207 -1.155 0 CA-C-N 115.124 -0.943 . . . . 0.0 112.413 -179.189 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.36 -31.24 71.86 Favored 'General case' 0 C--O 1.197 -1.689 0 C-N-CA 117.748 -1.581 . . . . 0.0 110.711 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -74.31 -46.49 40.7 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 121.393 0.616 . . . . 0.0 109.712 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.3 mt -59.78 -49.63 76.97 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.578 -179.052 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.768 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.6 p -73.3 -27.68 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.577 -178.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.31 -47.06 86.83 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 177.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.538 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 16.6 t80 -62.91 -45.69 91.34 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.068 174.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.66 94.12 Favored 'General case' 0 C--O 1.203 -1.352 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.216 -177.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -62.85 -44.79 95.19 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 123.29 0.636 . . . . 0.0 111.327 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.538 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 53.9 pttt -66.64 -36.49 82.7 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.645 0.736 . . . . 0.0 110.702 -177.69 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.509 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 69.4 t -75.23 -42.68 44.18 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.668 178.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.77 -43.3 90.33 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.23 -43.44 98.46 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.502 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.406 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 21.3 t70 -53.93 -51.97 62.08 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.257 0.623 . . . . 0.0 111.373 178.142 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.474 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -74.28 -27.6 60.81 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 179.66 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -63.86 -49.86 71.08 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 176.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -73.18 -22.63 60.44 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.979 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.3 t -81.37 -13.6 58.14 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.136 178.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.26 169.58 9.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.532 0.682 . . . . 0.0 112.487 -178.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -119.13 6.38 11.27 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.468 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.9 m -164.94 147.37 8.2 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.755 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -55.87 -40.39 72.87 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 175.343 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -56.17 -46.13 79.44 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.229 0.537 . . . . 0.0 110.139 178.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.65 -46.42 82.59 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.153 178.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -44.06 92.95 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 123.366 0.416 . . . . 0.0 109.994 -177.695 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -59.83 -47.58 85.15 Favored 'General case' 0 C--O 1.201 -1.45 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.631 175.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -62.31 -48.42 79.95 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -177.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.474 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.9 pp -71.97 -30.69 65.53 Favored 'General case' 0 C--O 1.258 1.507 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.273 -175.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.71 HD21 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -75.77 -33.6 60.2 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.554 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -62.07 -40.12 94.72 Favored 'General case' 0 C--O 1.198 -1.607 0 CA-C-N 115.03 -0.986 . . . . 0.0 108.781 176.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.87 -46.46 87.76 Favored 'General case' 0 C--O 1.259 1.58 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.932 177.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.77 -40.82 88.35 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.168 179.646 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 7.8 tt -67.08 -44.76 87.93 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.228 -178.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -52.64 -49.5 65.03 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 125.869 1.668 . . . . 0.0 111.215 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -69.18 -33.26 73.1 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.442 -179.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.549 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.5 mp -66.28 -39.28 83.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 116.772 -0.194 . . . . 0.0 110.707 175.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.592 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 22.5 mm-40 -58.62 -48.54 80.66 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.306 0.575 . . . . 0.0 109.491 178.427 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.735 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS 0.252 0.0 OUTLIER -69.5 -33.35 72.72 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 175.917 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -59.37 -45.92 90.1 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 176.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.4 pp -67.36 -39.71 85.73 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.459 -179.036 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.581 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 14.6 pt-20 -63.74 -45.16 91.16 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.04 0.382 . . . . 0.0 110.457 -178.15 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.57 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.7 pt-20 -76.01 -37.8 58.02 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.147 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -33.34 72.92 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.034 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 28.9 tpt180 -73.61 -38.35 65.11 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.455 ' O ' ' HD2' ' A' ' 84' ' ' ARG . 6.9 tmm_? -72.31 -18.02 61.81 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.585 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 70.2 m 92.75 116.9 0.02 OUTLIER 'General case' 0 C--N 1.349 0.546 0 C-N-CA 126.607 1.963 . . . . 0.0 109.288 -172.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -119.48 -11.75 9.44 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 C--N 1.302 -1.464 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.185 -177.595 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.045 0 N-CA-C 111.725 -0.55 . . . . 0.0 111.725 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 27.1 m -74.85 -33.39 62.12 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.662 0.268 . . . . 0.0 111.715 -178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 47.3 ttm -89.38 -27.42 20.46 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 43.4 t 76.27 134.4 0.06 Allowed 'General case' 0 C--O 1.24 0.595 0 C-N-CA 125.171 1.389 . . . . 0.0 109.992 -175.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 45.3 m80 -63.14 -41.22 99.25 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 47.5 t80 72.29 -12.96 0.66 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.571 1.548 . . . . 0.0 114.315 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -84.54 -75.16 1.22 Allowed Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.036 -1.078 . . . . 0.0 110.742 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -87.14 26.35 1.2 Allowed 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 123.5 0.72 . . . . 0.0 111.261 -177.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.13 -26.34 60.36 Favored 'General case' 0 C--O 1.213 -0.862 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 178.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 12.3 m -55.04 -45.9 75.26 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.434 1.094 . . . . 0.0 111.12 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.38 -57.12 12.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.091 -175.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -73.8 -36.55 65.01 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -174.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -70.14 -42.77 72.11 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 -178.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.566 HD21 ' HB3' ' A' ' 79' ' ' LEU . 48.8 tp -73.23 -24.69 60.52 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-O 120.765 0.317 . . . . 0.0 110.827 179.436 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.16 -42.34 66.02 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 175.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 30.7 m -68.83 -35.59 77.16 Favored 'General case' 0 CA--C 1.553 1.059 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.216 178.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 29.8 m -74.48 -26.64 60.14 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-O 121.36 0.6 . . . . 0.0 110.876 177.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 15.1 t70 -68.0 -48.53 65.49 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.1 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 7.6 p -69.71 -28.09 65.53 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.309 178.072 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.18 -36.72 83.83 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.414 0.685 . . . . 0.0 109.828 175.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 22.1 m -76.92 -14.3 59.88 Favored 'General case' 0 C--O 1.25 1.11 0 CA-C-O 121.612 0.72 . . . . 0.0 110.323 177.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 38.2 m80 73.98 -11.82 0.93 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.449 1.9 . . . . 0.0 114.286 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 5.5 p -160.43 172.01 18.03 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -172.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.84 144.83 56.58 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -132.62 -172.01 12.91 Favored Glycine 0 N--CA 1.427 -1.906 0 C-N-CA 118.939 -1.601 . . . . 0.0 114.553 -175.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 151.18 -137.47 6.06 Favored Glycine 0 N--CA 1.439 -1.115 0 N-CA-C 109.874 -1.29 . . . . 0.0 109.874 178.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 96.74 74.02 1.18 Allowed Glycine 0 N--CA 1.441 -1.021 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.394 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 17.8 m -64.63 107.62 1.46 Allowed 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.912 0.386 . . . . 0.0 110.52 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -123.95 159.85 18.55 Favored Glycine 0 N--CA 1.433 -1.547 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -135.2 55.84 0.72 Allowed Glycine 0 N--CA 1.44 -1.047 0 C-N-CA 120.664 -0.779 . . . . 0.0 113.045 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -76.73 116.32 4.61 Favored Glycine 0 C--O 1.247 0.959 0 N-CA-C 111.597 -0.601 . . . . 0.0 111.597 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 132' ' ' SER . . . . . 0.522 ' HB3' ' OE1' ' B' ' 138' ' ' GLU . 14.8 m -136.23 -176.46 4.33 Favored 'General case' 0 C--O 1.254 1.314 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -178.352 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 172.5 9.02 0.02 OUTLIER Glycine 0 CA--C 1.536 1.388 0 C-N-CA 120.738 -0.744 . . . . 0.0 114.128 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -109.03 -96.53 2.44 Favored Glycine 0 N--CA 1.441 -0.98 0 O-C-N 122.051 -0.676 . . . . 0.0 111.916 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 135' ' ' GLY . . . . . 0.527 ' O ' ' HG2' ' B' ' 138' ' ' GLU . . . 169.89 -150.85 15.58 Favored Glycine 0 N--CA 1.44 -1.061 0 C-N-CA 121.039 -0.6 . . . . 0.0 111.885 -178.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 29.0 m 67.26 -81.3 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 124.358 1.063 . . . . 0.0 112.4 179.332 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' B' ' 141' ' ' MET . 65.0 mt -106.23 -50.07 3.23 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-O 120.978 0.418 . . . . 0.0 111.032 -175.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' B' ' 135' ' ' GLY . 10.9 pt-20 -47.88 -36.3 11.91 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.889 1.811 . . . . 0.0 115.889 -168.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 14.2 p -65.15 -36.64 84.89 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.182 0.515 . . . . 0.0 112.16 -177.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -120.43 27.36 8.63 Favored 'General case' 0 CA--C 1.499 -0.999 0 CA-C-O 121.432 0.634 . . . . 0.0 109.443 -175.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.559 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 53.4 ttp -97.4 -15.77 20.52 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.509 -0.769 . . . . 0.0 113.002 -172.507 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -46.51 -58.09 4.1 Favored 'General case' 0 CA--C 1.568 1.646 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 -171.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 10.0 m -65.43 -39.57 92.26 Favored 'General case' 0 C--O 1.264 1.861 0 CA-C-O 121.922 0.868 . . . . 0.0 110.387 -176.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 47.1 mm -67.45 -44.87 86.53 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.133 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.365 -179.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.559 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 18.3 tt -67.82 -31.13 50.88 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-O 120.832 0.349 . . . . 0.0 111.494 -176.695 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -65.31 0.71 Allowed 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.062 171.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.7 p -61.1 -43.11 99.38 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -174.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -81.32 -46.69 14.35 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.554 ' HA ' ' HB1' ' A' ' 69' ' ' ALA 0.279 8.2 tt -88.16 -36.39 16.86 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -169.138 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.74 124.47 6.01 Favored 'General case' 0 CA--C 1.484 -1.591 0 C-N-CA 117.045 -1.862 . . . . 0.0 113.437 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -100.82 94.61 6.14 Favored 'General case' 0 C--N 1.277 -2.545 0 CA-C-N 114.107 -1.406 . . . . 0.0 109.004 176.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.274 -2.697 0 N-CA-C 106.134 -1.802 . . . . 0.0 106.134 173.532 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.554 0 N-CA-C 111.129 -0.789 . . . . 0.0 111.129 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 26.9 m -71.14 169.6 1.46 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.037 0 CA-C-O 121.075 0.464 . . . . 0.0 111.081 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -92.26 96.37 10.25 Favored 'General case' 0 N--CA 1.41 -2.45 0 C-N-CA 119.115 -1.034 . . . . 0.0 112.748 -171.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.465 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 82.9 mttt -127.19 124.92 40.11 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 114.269 -1.332 . . . . 0.0 108.292 175.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.58 -22.38 39.01 Favored Glycine 0 N--CA 1.464 0.56 0 O-C-N 123.904 0.752 . . . . 0.0 114.892 -173.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.465 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 68.9 p-90 -74.97 -5.02 41.66 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 122.216 -0.579 . . . . 0.0 112.173 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -61.04 -26.59 67.73 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 117.98 0.354 . . . . 0.0 110.941 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -78.13 -7.05 56.52 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.595 0.712 . . . . 0.0 110.368 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -102.35 3.14 37.65 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.817 -177.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.406 HG23 HD12 ' A' ' 14' ' ' LEU . 6.0 p -136.52 109.55 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.843 0 CA-C-O 122.157 0.98 . . . . 0.0 108.839 -179.213 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.5 m -86.37 155.76 20.47 Favored 'General case' 0 C--N 1.286 -2.162 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.376 -175.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -50.71 -39.47 51.61 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.409 1.084 . . . . 0.0 110.928 177.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -57.43 -41.11 79.8 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 178.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.542 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.1 tm? -69.02 -52.31 30.0 Favored 'General case' 0 CA--C 1.485 -1.543 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -175.019 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.574 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.8 ptm180 -64.5 -44.67 90.22 Favored 'General case' 0 N--CA 1.413 -2.299 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.985 -176.156 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 t -64.21 -29.93 71.01 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.946 0.403 . . . . 0.0 110.038 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -66.18 -45.57 80.39 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.736 HD23 HD21 ' A' ' 68' ' ' LEU . 4.9 mp -66.24 -39.42 89.52 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.739 177.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 15' ' ' ARG . 62.2 t -58.15 -50.18 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 124.329 1.052 . . . . 0.0 110.361 175.244 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -54.8 -46.56 74.51 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.483 177.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -65.94 -38.83 89.65 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.848 177.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.513 ' O ' HG22 ' A' ' 26' ' ' ILE . 20.7 mt -52.09 -49.31 63.84 Favored 'General case' 0 CA--C 1.498 -1.033 0 O-C-N 123.859 0.724 . . . . 0.0 110.023 174.541 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.458 HG13 ' HB3' ' A' ' 43' ' ' LEU . 71.2 t -56.62 -52.36 54.64 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.677 0 O-C-N 124.139 0.899 . . . . 0.0 109.825 175.299 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -53.58 -34.5 58.58 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -178.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.5 -45.9 15.3 Favored 'General case' 0 C--O 1.2 -1.539 0 CA-C-O 121.152 0.501 . . . . 0.0 111.917 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.533 HG13 ' CZ ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -75.31 -32.94 26.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-O 121.365 0.602 . . . . 0.0 110.679 -175.05 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.501 ' CD2' HG23 ' A' ' 26' ' ' ILE . 56.4 m-85 -128.56 91.57 43.22 Favored Pre-proline 0 C--N 1.283 -2.284 0 C-N-CA 124.801 1.24 . . . . 0.0 108.256 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.21 96.55 0.34 Allowed 'Trans proline' 0 N--CA 1.447 -1.224 0 C-N-CA 121.51 1.473 . . . . 0.0 110.062 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.8 t -52.64 123.56 31.1 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.879 -176.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.88 -16.88 29.28 Favored 'Trans proline' 0 C--O 1.237 0.451 0 C-N-CA 122.389 2.059 . . . . 0.0 112.27 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -163.39 148.54 9.26 Favored Pre-proline 0 N--CA 1.446 -0.638 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -174.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.43 ' O ' HD12 ' A' ' 35' ' ' LEU . 4.8 Cg_endo -52.57 -27.59 33.3 Favored 'Trans proline' 0 CA--C 1.559 1.749 0 C-N-CA 123.34 2.694 . . . . 0.0 113.172 173.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.63 -11.61 57.05 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 121.133 -0.98 . . . . 0.0 111.813 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.44 -42.1 30.93 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.085 0.469 . . . . 0.0 110.692 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.43 HD12 ' O ' ' A' ' 32' ' ' PRO 0.326 0.3 OUTLIER -75.84 8.51 3.02 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 178.039 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -133.06 17.97 4.11 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.408 0.623 . . . . 0.0 110.263 174.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.574 ' O ' ' HB3' ' A' ' 40' ' ' MET . 36.6 t70 -93.21 -178.38 4.75 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.721 -178.292 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.536 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.91 -22.45 62.25 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.916 -0.49 . . . . 0.0 110.46 179.246 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.571 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 42.3 ttm180 -73.27 -21.9 60.5 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.516 0.674 . . . . 0.0 109.716 176.176 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.657 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.4 tpp -61.55 -34.53 75.72 Favored 'General case' 0 C--O 1.197 -1.704 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.869 177.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.615 ' HA ' HG12 ' A' ' 44' ' ' VAL . 12.9 pt-20 -66.97 -24.86 66.1 Favored 'General case' 0 C--O 1.2 -1.531 0 C-N-CA 118.33 -1.348 . . . . 0.0 110.844 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -74.28 -44.58 52.18 Favored 'General case' 0 C--O 1.249 1.063 0 CA-C-O 121.485 0.659 . . . . 0.0 109.548 174.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.4 mt -63.08 -49.12 75.75 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.504 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.657 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 2.6 p -70.58 -27.89 32.7 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.337 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.685 -178.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.31 96.28 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 176.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.572 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.1 t80 -60.79 -47.76 84.85 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 173.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.81 -43.41 94.53 Favored 'General case' 0 C--O 1.197 -1.709 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.999 -176.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -64.0 -42.39 97.17 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 123.525 0.73 . . . . 0.0 112.06 177.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.4 pttp -68.01 -37.09 81.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.489 0.661 . . . . 0.0 110.056 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.486 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 52.9 t -73.06 -49.41 38.93 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.576 178.103 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 13.8 tm-20 -56.62 -46.07 81.16 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 124.112 0.965 . . . . 0.0 109.202 178.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.493 ' O ' ' HG2' ' A' ' 56' ' ' GLU . . . -58.01 -48.19 84.24 Favored Glycine 0 N--CA 1.432 -1.609 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.88 178.307 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -56.71 -51.16 69.87 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.118 0.485 . . . . 0.0 111.781 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.512 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -67.99 -29.62 68.68 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 179.139 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.421 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 65.6 t80 -62.75 -51.52 66.83 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 176.428 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 52' ' ' GLY . 5.9 mm-40 -71.95 -24.48 61.62 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.691 -177.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 t -79.55 -22.05 44.33 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.312 0.577 . . . . 0.0 110.183 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -93.15 162.81 13.87 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 121.157 0.504 . . . . 0.0 111.171 -177.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -118.51 19.01 13.45 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.647 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.5 p -167.21 157.2 10.98 Favored 'General case' 0 CA--C 1.488 -1.441 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 171.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HA ' ' HD2' ' A' ' 64' ' ' TYR . 0.1 OUTLIER -72.29 -26.1 61.84 Favored 'General case' 0 C--N 1.308 -1.196 0 C-N-CA 119.241 -0.984 . . . . 0.0 111.432 179.135 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -65.53 -47.37 76.15 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.87 -47.31 86.27 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.865 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.416 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -65.19 -46.63 79.97 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.963 -176.892 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 2.4 t80 -60.99 -43.43 98.88 Favored 'General case' 0 C--O 1.203 -1.351 0 O-C-N 123.8 0.687 . . . . 0.0 110.301 178.061 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.436 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 31.8 t-80 -62.88 -54.66 35.24 Favored 'General case' 0 C--O 1.214 -0.789 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.1 pp -65.39 -33.64 76.43 Favored 'General case' 0 C--O 1.272 2.286 0 CA-C-O 121.413 0.625 . . . . 0.0 111.634 -175.472 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.736 HD21 HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -73.79 -35.29 64.9 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.236 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.556 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.78 -34.49 78.02 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.159 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 17.4 mt-10 -68.44 -46.76 69.0 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 120.134 -0.626 . . . . 0.0 110.055 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -64.73 -36.83 85.55 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 119.501 -0.88 . . . . 0.0 111.512 -179.038 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.642 HD13 HD11 ' B' ' 149' ' ' LEU . 8.9 tt -69.31 -47.07 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.576 179.446 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.483 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 23.0 t80 -51.68 -49.94 61.4 Favored 'General case' 0 C--O 1.256 1.427 0 C-N-CA 125.889 1.676 . . . . 0.0 111.063 178.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -67.35 -34.64 77.74 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.679 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.557 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.3 mp -68.79 -34.83 66.68 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 CA-C-O 120.603 0.239 . . . . 0.0 111.086 177.419 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 72' ' ' ILE . 22.1 mm-40 -62.06 -49.52 75.67 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.505 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS . 0.5 OUTLIER -71.92 -31.04 65.97 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 119.656 -0.818 . . . . 0.0 113.088 177.491 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -57.92 -50.35 73.65 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 175.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -64.93 -36.95 86.04 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.379 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 77' ' ' LYS . 3.2 mm-40 -61.01 -53.54 56.01 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.131 0.572 . . . . 0.0 111.612 177.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -69.5 -39.8 77.4 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.854 -177.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.61 -34.23 77.76 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -178.766 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -77.76 -40.89 39.42 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.904 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.9 tpp180 -71.84 -59.43 2.75 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.256 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 39.1 m 166.13 87.69 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 126.72 2.008 . . . . 0.0 109.757 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -97.14 -28.74 13.97 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 174.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 69.7 mt . . . . . 0 C--O 1.251 1.176 0 CA-C-N 113.859 -1.519 . . . . 0.0 109.02 177.533 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.593 0 N-CA-C 111.28 -0.728 . . . . 0.0 111.28 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 13.9 t -97.36 -36.78 10.27 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 92.9 mmm -85.84 -17.64 35.08 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.853 0.835 . . . . 0.0 110.159 177.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 16.7 t -95.11 109.91 21.92 Favored 'General case' 0 N--CA 1.411 -2.412 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 174.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -86.06 154.8 21.15 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 120.089 -0.644 . . . . 0.0 110.871 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 106' ' ' TYR . . . . . 0.557 ' HA ' ' NE2' ' B' ' 109' ' ' GLN . 51.9 p90 -171.94 160.83 5.56 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 106.141 -1.799 . . . . 0.0 106.141 -174.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 78.26 -59.43 3.99 Favored Glycine 0 C--N 1.308 -0.974 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 -178.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -74.66 27.88 0.09 Allowed 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 125.477 1.511 . . . . 0.0 112.902 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.557 ' NE2' ' HA ' ' B' ' 106' ' ' TYR . 2.8 mm-40 -71.37 -36.31 71.4 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.837 -175.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 3.8 p -71.1 -38.78 72.37 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.848 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 31.8 tp -57.17 -58.06 9.88 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.701 176.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -67.78 -37.3 81.88 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.779 -176.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -63.72 -52.6 59.79 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.49 HD21 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -68.97 -30.32 68.71 Favored 'General case' 0 C--O 1.207 -1.151 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.603 -178.087 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.3 tp -65.37 -36.93 85.48 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 176.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 62.4 m -64.36 -46.39 83.6 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.408 ' O ' ' HB3' ' B' ' 120' ' ' LEU . 14.7 m -67.03 -34.69 78.25 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.974 178.392 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -64.91 -34.1 77.6 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 123.901 0.881 . . . . 0.0 108.85 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 38.9 m -71.93 -25.49 61.92 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.658 177.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' B' ' 117' ' ' SER . 8.0 tt -66.14 -45.66 80.25 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 16.7 m -64.52 -49.8 69.89 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 174.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 18.2 t60 71.37 -62.0 0.47 Allowed 'General case' 0 C--N 1.341 0.203 0 C-N-CA 125.722 1.609 . . . . 0.0 112.054 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 36.3 p -96.13 76.46 3.06 Favored 'General case' 0 N--CA 1.417 -2.08 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.635 -176.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 44.7 t0 68.54 176.27 0.27 Allowed 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 124.434 1.094 . . . . 0.0 112.103 175.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -157.45 130.64 2.67 Favored Glycine 0 N--CA 1.435 -1.426 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -151.01 103.77 0.25 Allowed Glycine 0 N--CA 1.437 -1.238 0 C-N-CA 120.447 -0.883 . . . . 0.0 113.306 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -134.46 149.41 19.81 Favored Glycine 0 C--N 1.305 -1.165 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 44.8 m -141.0 173.22 11.69 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 117.904 0.852 . . . . 0.0 111.535 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -156.61 130.19 2.62 Favored Glycine 0 N--CA 1.435 -1.42 0 N-CA-C 109.126 -1.59 . . . . 0.0 109.126 176.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -108.1 -168.36 21.4 Favored Glycine 0 C--N 1.302 -1.35 0 C-N-CA 120.018 -1.087 . . . . 0.0 112.682 -176.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -124.51 178.56 16.44 Favored Glycine 0 N--CA 1.434 -1.486 0 N-CA-C 110.229 -1.148 . . . . 0.0 110.229 178.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.0 t -178.48 -77.23 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -178.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -111.79 159.05 13.94 Favored Glycine 0 N--CA 1.432 -1.612 0 N-CA-C 109.219 -1.552 . . . . 0.0 109.219 174.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -162.27 99.68 0.17 Allowed Glycine 0 N--CA 1.425 -2.058 0 C-N-CA 119.911 -1.137 . . . . 0.0 112.685 -178.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -159.06 16.94 0.25 Allowed Glycine 0 C--N 1.305 -1.149 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 177.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.565 ' HB3' ' H ' ' B' ' 140' ' ' ASP . 22.8 t -167.34 165.8 14.89 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 -176.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.552 ' O ' ' HB3' ' B' ' 141' ' ' MET . 2.7 pt? -93.72 -47.21 6.89 Favored 'General case' 0 C--O 1.184 -2.349 0 C-N-CA 119.486 -0.886 . . . . 0.0 109.863 174.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.434 ' HB3' ' HB2' ' A' ' 14' ' ' LEU 0.277 19.5 pt-20 -85.64 -28.81 24.52 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 116.489 2.033 . . . . 0.0 116.489 -177.88 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 44.2 t -100.36 -61.36 1.38 Allowed 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 118.984 -1.086 . . . . 0.0 112.922 -174.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 140' ' ' ASP . . . . . 0.565 ' H ' ' HB3' ' B' ' 136' ' ' SER . 13.9 m-20 -115.91 82.83 1.83 Allowed 'General case' 0 CA--C 1.476 -1.898 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -178.553 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.552 ' HB3' ' O ' ' B' ' 137' ' ' LEU . 17.8 ptm -103.0 -37.21 7.88 Favored 'General case' 0 C--O 1.181 -2.544 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -167.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.483 ' CD ' ' H ' ' B' ' 142' ' ' GLU . 1.8 mp0 -26.92 -61.1 0.09 Allowed 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -167.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 28.5 m -71.27 -38.19 71.88 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.834 -0.541 . . . . 0.0 111.671 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 48.0 mm -68.68 -47.56 75.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.504 ' HA ' ' OH ' ' A' ' 65' ' ' TYR . 7.9 tp -61.75 -39.07 82.01 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.307 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 41.3 ttt180 -65.35 -49.5 69.11 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 118.573 -1.251 . . . . 0.0 110.82 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 28.9 m -66.08 -44.84 83.28 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.0 -40.28 39.57 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 121.076 -0.249 . . . . 0.0 111.586 -175.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.642 HD11 HD13 ' A' ' 72' ' ' ILE . 2.8 tm? -79.48 -50.73 10.31 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.358 -173.034 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.47 ' SD ' HD12 ' B' ' 149' ' ' LEU . 0.0 OUTLIER -149.4 83.49 1.42 Allowed 'General case' 0 C--O 1.244 0.768 0 C-N-CA 118.027 -1.469 . . . . 0.0 114.483 -178.406 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 76.39 149.77 0.11 Allowed 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 169.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.116 0 CA-C-N 114.393 -1.276 . . . . 0.0 108.293 177.063 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.568 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.0 m -94.58 134.46 31.97 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.486 ' H ' ' HD2' ' A' ' 3' ' ' ARG . 0.2 OUTLIER -102.82 110.37 22.27 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 121.724 0.773 . . . . 0.0 111.706 -177.906 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.615 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.2 ptpt -152.08 84.29 1.27 Allowed 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 114.58 -1.191 . . . . 0.0 110.175 177.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.02 -8.4 8.33 Favored Glycine 0 C--O 1.243 0.669 0 CA-C-N 114.29 -1.323 . . . . 0.0 115.471 -173.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.615 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 59.7 p-90 -62.48 -16.25 54.4 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 117.129 0.465 . . . . 0.0 111.405 177.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -59.97 -11.84 6.6 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 178.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -89.82 -8.31 52.35 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.034 0.445 . . . . 0.0 110.336 178.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -107.6 13.61 26.51 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.628 0.728 . . . . 0.0 111.042 -174.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.3 p -134.14 110.52 13.86 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.205 0 CA-C-O 122.156 0.979 . . . . 0.0 108.598 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.9 m -81.16 154.35 26.76 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.197 -173.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.425 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 1.5 tm0? -59.49 -34.84 73.08 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.415 178.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.98 -39.21 81.05 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.941 176.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.536 ' O ' HD13 ' A' ' 18' ' ' LEU . 2.9 tm? -69.67 -52.43 25.82 Favored 'General case' 0 CA--C 1.493 -1.247 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 -177.256 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.568 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.2 ptm180 -65.1 -44.17 89.7 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.882 -175.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.0 t -66.52 -27.13 67.52 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 24.9 t60 -67.62 -46.31 72.87 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.705 HD23 HD21 ' A' ' 68' ' ' LEU . 5.1 mp -63.89 -38.99 93.13 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.698 177.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.6 t -58.19 -48.38 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 123.644 0.778 . . . . 0.0 109.972 174.403 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.537 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 18.5 t-80 -55.37 -45.85 76.5 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.445 0.698 . . . . 0.0 110.351 177.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.581 ' HD3' HD22 ' B' ' 149' ' ' LEU . 34.1 mttp -65.67 -38.65 89.87 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.87 178.237 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.99 -44.65 82.91 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.537 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 25.1 t -53.73 -49.36 57.91 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.906 0 C-N-CA 124.055 0.942 . . . . 0.0 110.931 172.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -69.61 -25.86 64.16 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.029 -0.668 . . . . 0.0 112.58 -176.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.421 ' O ' HD11 ' B' ' 114' ' ' LEU . . . -78.83 -42.18 28.3 Favored 'General case' 0 C--O 1.196 -1.732 0 C-N-CA 120.971 -0.292 . . . . 0.0 110.747 174.038 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.496 ' HA ' HD21 ' B' ' 114' ' ' LEU . 3.9 tt -70.68 -38.82 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 119.902 -0.719 . . . . 0.0 111.194 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.421 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 84.4 t80 -125.52 99.09 33.61 Favored Pre-proline 0 N--CA 1.415 -2.192 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -175.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 19.5 Cg_endo -60.43 97.84 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 121.735 1.623 . . . . 0.0 108.815 170.186 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.0 t -75.8 136.68 70.24 Favored Pre-proline 0 N--CA 1.426 -1.664 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.624 -176.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.48 -21.3 11.68 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 122.498 2.132 . . . . 0.0 111.677 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -158.31 141.93 11.11 Favored Pre-proline 0 CA--C 1.496 -1.133 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -176.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -55.49 -20.04 25.16 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.913 2.409 . . . . 0.0 114.61 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.9 -10.04 59.41 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 121.171 -0.956 . . . . 0.0 112.03 179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -6.56 55.24 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.179 0.99 . . . . 0.0 108.828 174.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.506 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.4 mt -90.94 5.65 47.85 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.22 -179.255 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.13 26.96 4.21 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 176.1 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.57 ' O ' ' HB3' ' A' ' 40' ' ' MET . 22.7 t70 -92.29 173.08 8.0 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.627 -1.169 . . . . 0.0 109.424 -177.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.544 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.26 -25.94 62.68 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.209 0.528 . . . . 0.0 110.324 177.811 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.526 ' HD3' HD21 ' B' ' 120' ' ' LEU . 33.7 ttm180 -72.19 -27.43 62.55 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-O 121.589 0.709 . . . . 0.0 109.951 176.043 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.639 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 4.8 tpp -57.25 -37.41 72.26 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.242 178.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -61.44 -29.08 69.72 Favored 'General case' 0 C--O 1.202 -1.407 0 C-N-CA 119.023 -1.071 . . . . 0.0 110.245 -179.219 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.489 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.3 t30 -69.68 -48.63 59.03 Favored 'General case' 0 C--O 1.253 1.25 0 C-N-CA 122.849 0.46 . . . . 0.0 109.993 175.192 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.446 HD22 ' O ' ' A' ' 39' ' ' ARG . 2.7 mm? -61.97 -51.61 67.37 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.274 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.639 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -67.77 -29.21 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.832 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.082 -176.527 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.96 92.27 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.097 0.475 . . . . 0.0 109.865 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.57 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 1.7 t80 -62.38 -46.86 86.72 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.622 174.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.81 91.54 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.092 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -64.75 -44.28 90.59 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 123.742 0.817 . . . . 0.0 112.487 177.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.7 pttp -64.77 -39.94 94.44 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-O 121.489 0.661 . . . . 0.0 109.532 -178.63 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.1 t -67.68 -53.24 32.84 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.978 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -55.4 -48.33 74.52 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 124.036 0.934 . . . . 0.0 110.02 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.37 -37.79 94.65 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.486 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -64.52 -47.76 77.64 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 121.398 0.618 . . . . 0.0 110.718 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.471 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -70.28 -29.49 66.27 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 121.817 -0.552 . . . . 0.0 112.11 176.688 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -62.9 -54.7 34.54 Favored 'General case' 0 C--O 1.193 -1.873 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -68.99 -27.2 65.48 Favored 'General case' 0 C--N 1.307 -1.252 0 O-C-N 122.027 -0.421 . . . . 0.0 111.563 -177.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.2 t -74.34 -32.97 62.99 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 123.504 0.721 . . . . 0.0 112.455 -178.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.03 159.92 30.33 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -174.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -98.93 -1.98 38.65 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.171 178.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.434 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 66.4 p -168.17 158.0 9.84 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.529 174.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.486 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -62.56 -35.62 80.05 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -179.318 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -67.57 -33.67 75.5 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -70.75 -44.76 66.09 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.683 175.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -45.8 89.14 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.481 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 1.3 t80 -60.74 -46.59 89.83 Favored 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.031 176.36 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -59.18 -52.04 67.42 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.471 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -67.88 -37.63 82.02 Favored 'General case' 0 C--O 1.267 2.016 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.944 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.705 HD21 HD23 ' A' ' 18' ' ' LEU . 1.5 pp -68.9 -36.62 78.26 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.529 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.02 -41.21 97.52 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.607 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -62.77 -46.42 88.11 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.542 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -38.07 69.94 Favored 'General case' 0 N--CA 1.438 -1.047 0 C-N-CA 118.935 -1.106 . . . . 0.0 112.14 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.541 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 4.2 tt -65.26 -45.83 92.46 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.15 178.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.489 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 17.8 t80 -53.29 -53.34 52.37 Favored 'General case' 0 C--O 1.272 2.259 0 C-N-CA 125.37 1.468 . . . . 0.0 111.409 178.831 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.3 ptpt -63.72 -34.22 77.39 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.756 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.78 -40.78 84.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 O-C-N 123.5 0.5 . . . . 0.0 111.913 177.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.601 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.4 mm-40 -57.96 -53.59 56.57 Favored 'General case' 0 C--O 1.253 1.239 0 CA-C-O 121.967 0.889 . . . . 0.0 109.554 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.545 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 12.2 ptpt -70.3 -32.53 70.35 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 118.977 -1.089 . . . . 0.0 112.888 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.491 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 18.6 tp10 -62.34 -46.35 89.07 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.2 pp -63.45 -43.27 97.86 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.042 -177.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.495 ' N ' HD12 ' A' ' 79' ' ' LEU . 7.2 pt-20 -69.38 -43.82 72.74 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 118.809 -1.156 . . . . 0.0 112.156 -178.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 13.3 pt-20 -69.98 -32.27 70.4 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 120.325 -0.55 . . . . 0.0 112.066 -178.008 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.676 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.3 OUTLIER -72.93 -35.5 67.02 Favored 'General case' 0 C--O 1.215 -0.761 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.221 177.647 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.416 ' HD3' ' OD2' ' B' ' 118' ' ' ASP . 18.5 tpt180 -71.23 -31.54 67.69 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.149 -179.333 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -101.7 -54.39 2.75 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 -173.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 30.7 p -120.54 -30.22 4.57 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 118.491 2.775 . . . . 0.0 118.491 -167.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.676 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 3.1 ptp180 -88.15 -23.05 23.74 Favored 'General case' 0 C--N 1.27 -2.866 0 C-N-CA 117.976 -1.49 . . . . 0.0 111.482 -175.56 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 57.1 mt . . . . . 0 C--O 1.248 0.978 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 178.49 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.885 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 23.3 m -86.27 87.22 7.39 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 83.6 mmm -93.78 -26.99 16.73 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.78 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 104' ' ' SER . . . . . 0.482 ' HA ' ' NE2' ' B' ' 112' ' ' GLN . 22.9 t -90.73 -167.92 1.95 Allowed 'General case' 0 N--CA 1.426 -1.672 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.696 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 105' ' ' HIS . . . . . 0.496 ' O ' ' HB3' ' B' ' 109' ' ' GLN . 51.2 m-70 -133.95 172.01 13.39 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 -176.582 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -111.84 112.88 24.87 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 173.129 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 103.45 -71.83 0.28 Allowed Glycine 0 N--CA 1.429 -1.832 0 N-CA-C 110.78 -0.928 . . . . 0.0 110.78 -175.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -82.9 20.35 1.2 Allowed 'General case' 0 N--CA 1.478 0.929 0 CA-C-O 121.418 0.628 . . . . 0.0 111.547 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.496 ' HB3' ' O ' ' B' ' 105' ' ' HIS . 2.5 pp0? -62.82 -18.52 62.94 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.39 0.615 . . . . 0.0 110.262 173.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 110' ' ' THR . . . . . 0.571 ' O ' ' HB2' ' B' ' 114' ' ' LEU . 1.0 OUTLIER -60.03 -24.64 64.68 Favored 'General case' 0 N--CA 1.411 -2.415 0 C-N-CA 125.428 1.491 . . . . 0.0 112.25 179.3 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.23 -58.57 8.04 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.243 0.544 . . . . 0.0 110.324 176.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 112' ' ' GLN . . . . . 0.482 ' NE2' ' HA ' ' B' ' 104' ' ' SER . 10.2 pt20 -76.04 -28.78 57.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.665 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 113' ' ' ASP . . . . . 0.537 ' HB3' ' HA ' ' B' ' 110' ' ' THR . 26.0 t70 -65.59 -45.26 83.89 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.88 176.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.571 ' HB2' ' O ' ' B' ' 110' ' ' THR . 0.1 OUTLIER -69.61 -31.59 69.81 Favored 'General case' 0 C--O 1.191 -2.007 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.524 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 58.9 tp -62.37 -33.35 74.57 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 121.211 0.529 . . . . 0.0 110.135 175.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 40.9 m -72.15 -43.69 64.25 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.477 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.509 ' O ' ' HB3' ' B' ' 120' ' ' LEU . 13.5 p -73.52 -26.89 61.08 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-O 121.442 0.639 . . . . 0.0 110.909 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.416 ' OD2' ' HD3' ' A' ' 83' ' ' ARG . 5.4 t70 -62.34 -42.85 99.73 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 124.456 1.102 . . . . 0.0 109.695 173.095 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 20.6 t -67.98 -33.49 74.74 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.277 178.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.526 HD21 ' HD3' ' A' ' 39' ' ' ARG . 4.2 tt -62.65 -51.16 68.34 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 46.2 m -60.96 -53.22 59.88 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.559 177.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 60.08 29.93 19.45 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.549 1.139 . . . . 0.0 109.844 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 4.6 p -148.37 170.72 17.34 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.263 -176.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -90.65 135.79 33.48 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 122.358 0.263 . . . . 0.0 110.814 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -167.71 175.11 42.72 Favored Glycine 0 N--CA 1.432 -1.616 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -179.18 37.74 0.08 OUTLIER Glycine 0 C--N 1.307 -1.031 0 N-CA-C 111.124 -0.79 . . . . 0.0 111.124 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.24 -177.02 53.82 Favored Glycine 0 N--CA 1.438 -1.199 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.959 178.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 36.9 m -147.99 134.41 19.64 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 155.61 146.44 4.44 Favored Glycine 0 N--CA 1.432 -1.621 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -105.79 -127.32 5.88 Favored Glycine 0 N--CA 1.435 -1.415 0 N-CA-C 110.173 -1.171 . . . . 0.0 110.173 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 131' ' ' GLY . . . . . 0.479 ' HA2' ' HB3' ' B' ' 142' ' ' GLU . . . 162.68 88.15 0.07 OUTLIER Glycine 0 N--CA 1.427 -1.928 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.112 177.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 4.9 p -91.69 -45.61 8.36 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 113.523 0.934 . . . . 0.0 113.523 178.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 133' ' ' GLY . . . . . 0.534 ' O ' ' HB2' ' B' ' 142' ' ' GLU . . . -158.69 146.29 12.91 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 119.003 -1.57 . . . . 0.0 113.378 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -156.46 147.41 15.87 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 110.481 -1.047 . . . . 0.0 110.481 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -148.71 11.26 1.1 Allowed Glycine 0 C--O 1.241 0.586 0 N-CA-C 112.147 -0.381 . . . . 0.0 112.147 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.6 t -163.88 -167.19 1.31 Allowed 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.611 ' O ' ' HB3' ' B' ' 141' ' ' MET . 2.3 pt? -105.31 -49.54 3.43 Favored 'General case' 0 C--O 1.191 -2.003 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.32 178.473 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.491 ' HA ' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.46 -44.8 14.35 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 -171.917 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 28.3 t -87.28 -54.25 4.4 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.738 -176.4 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -129.39 95.77 4.11 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -177.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.611 ' HB3' ' O ' ' B' ' 137' ' ' LEU . 21.5 ptp -102.36 -39.3 7.24 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 117.027 2.232 . . . . 0.0 117.027 -168.289 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.534 ' HB2' ' O ' ' B' ' 133' ' ' GLY . 47.1 mt-10 -21.92 -64.77 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 118.717 2.858 . . . . 0.0 118.717 -165.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 19.4 p -67.65 -44.69 77.3 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.172 0.511 . . . . 0.0 111.721 -171.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 57.2 mt -66.55 -46.6 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.946 -178.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 145' ' ' ILE . . . . . 0.485 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 18.2 tt -67.65 -33.36 61.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -69.64 -52.45 25.77 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.642 176.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.3 m -64.85 -41.81 95.39 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -176.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -81.08 -39.89 24.99 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -177.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.581 HD22 ' HD3' ' A' ' 21' ' ' LYS . 8.3 tt -98.46 -30.24 12.65 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 -169.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 25.7 ptm -166.17 119.18 1.08 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -176.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -93.15 120.84 33.89 Favored 'General case' 0 CA--C 1.489 -1.394 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 166.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.294 -1.837 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -177.84 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.491 -1.459 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.6 m -92.88 143.07 12.19 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 175.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.0 60.67 6.39 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-O 122.039 0.923 . . . . 0.0 112.299 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.458 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 79.3 mttt -138.97 114.12 9.49 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.008 -179.574 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.31 -20.55 10.43 Favored Glycine 0 N--CA 1.466 0.648 0 N-CA-C 115.69 1.036 . . . . 0.0 115.69 -174.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.458 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 67.2 p-90 -70.39 -12.57 61.67 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 122.287 -0.537 . . . . 0.0 111.986 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -58.96 -21.2 58.05 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-O 120.92 0.391 . . . . 0.0 111.955 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -82.38 -13.48 56.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.477 0.656 . . . . 0.0 110.316 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -94.24 2.26 55.91 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.218 -176.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.457 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.9 p -129.12 110.86 21.44 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 CA-C-O 121.416 0.627 . . . . 0.0 110.07 -177.473 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 m -88.72 157.19 18.6 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.928 -176.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.4 tm0? -53.59 -37.32 62.85 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.841 0.856 . . . . 0.0 111.267 178.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.07 -35.36 80.01 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.569 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -70.49 -52.0 25.03 Favored 'General case' 0 CA--C 1.488 -1.438 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -176.112 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.509 ' O ' HG23 ' A' ' 19' ' ' VAL . 3.7 ptm180 -63.32 -44.62 94.43 Favored 'General case' 0 N--CA 1.42 -1.96 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.996 -178.276 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 t -61.95 -31.49 71.84 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.785 0.326 . . . . 0.0 110.445 178.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -66.66 -45.47 78.84 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.822 HD23 HD21 ' A' ' 68' ' ' LEU . 7.0 mp -67.32 -40.84 86.01 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.221 178.365 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 15' ' ' ARG . 54.6 t -56.47 -49.96 74.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 124.306 1.043 . . . . 0.0 109.828 175.012 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -58.12 -44.12 87.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.095 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -66.6 -40.92 89.1 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.931 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.524 ' O ' HG22 ' A' ' 26' ' ' ILE . 11.7 mt -50.83 -51.12 54.19 Favored 'General case' 0 CA--C 1.5 -0.959 0 O-C-N 124.211 0.944 . . . . 0.0 109.057 173.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.466 HG11 ' CE ' ' A' ' 40' ' ' MET . 79.2 t -55.23 -52.89 40.66 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.799 0 O-C-N 124.484 1.115 . . . . 0.0 111.05 175.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -52.46 -35.83 53.38 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB2' HE21 ' A' ' 76' ' ' GLN . . . -81.89 -46.48 14.03 Favored 'General case' 0 C--O 1.2 -1.518 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 176.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.625 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.5 -24.76 14.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-O 122.218 1.009 . . . . 0.0 110.499 -174.111 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.625 ' CD2' HG23 ' A' ' 26' ' ' ILE . 75.1 m-85 -131.01 86.52 51.53 Favored Pre-proline 0 C--N 1.271 -2.828 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.497 178.384 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -61.22 104.88 0.31 Allowed 'Trans proline' 0 N--CA 1.441 -1.57 0 N-CA-C 108.636 -1.332 . . . . 0.0 108.636 175.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.9 t -72.68 143.03 84.29 Favored Pre-proline 0 N--CA 1.422 -1.865 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.751 -173.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -77.94 -29.51 4.25 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.226 2.618 . . . . 0.0 111.073 175.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -137.72 135.92 19.54 Favored Pre-proline 0 CA--C 1.493 -1.215 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -176.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -63.8 -18.42 63.92 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 121.472 1.448 . . . . 0.0 111.587 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.7 -15.25 55.04 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 121.748 -0.595 . . . . 0.0 111.189 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.76 -16.21 63.27 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 121.468 0.652 . . . . 0.0 109.353 175.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.5 mt -81.02 3.4 23.21 Favored 'General case' 0 C--O 1.214 -0.809 0 CA-C-N 114.496 -1.229 . . . . 0.0 110.547 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.81 10.85 2.89 Favored 'General case' 0 C--N 1.288 -2.095 0 O-C-N 121.366 -0.834 . . . . 0.0 110.099 170.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 40' ' ' MET . 1.9 t70 -104.72 -167.3 1.33 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.202 -170.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -61.92 -36.39 81.23 Favored 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 118.264 0.484 . . . . 0.0 111.632 -177.093 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.554 ' O ' HD13 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -64.55 -33.82 76.8 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -177.864 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.569 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.77 -33.45 71.7 Favored 'General case' 0 C--O 1.171 -3.074 0 CA-C-O 118.435 -0.793 . . . . 0.0 111.1 -178.899 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 8.1 pt-20 -64.05 -34.18 77.43 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.235 0.925 . . . . 0.0 110.477 -176.154 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -71.81 -45.62 60.92 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.819 0.818 . . . . 0.0 109.379 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.562 HD22 ' HA ' ' A' ' 40' ' ' MET . 0.3 OUTLIER -57.01 -52.61 64.59 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 113.946 -1.479 . . . . 0.0 110.808 -179.147 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 40' ' ' MET . 27.6 m -69.97 -32.02 50.0 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.487 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.347 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.64 -48.86 74.28 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 175.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.584 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 9.7 t80 -63.92 -48.66 75.69 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.943 174.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.419 ' CB ' HG13 ' A' ' 19' ' ' VAL . . . -61.03 -40.66 94.43 Favored 'General case' 0 C--O 1.196 -1.752 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.498 -176.03 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 mttm -66.09 -42.28 89.54 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 123.676 0.79 . . . . 0.0 111.533 178.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.0 pttp -65.47 -40.65 93.4 Favored 'General case' 0 C--O 1.254 1.309 0 CA-C-O 121.443 0.639 . . . . 0.0 110.19 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.424 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 78.3 t -71.56 -47.5 57.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.519 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -57.93 -47.68 82.15 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 123.53 0.732 . . . . 0.0 109.269 179.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.31 -39.46 92.65 Favored Glycine 0 CA--C 1.505 -0.551 0 O-C-N 123.673 0.608 . . . . 0.0 112.104 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.0 -54.26 48.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.034 0.445 . . . . 0.0 110.804 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.518 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -67.89 -29.3 68.37 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 179.019 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -61.63 -54.39 43.54 Favored 'General case' 0 C--O 1.2 -1.526 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 176.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -74.02 -22.12 59.7 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.826 -0.546 . . . . 0.0 111.815 -176.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -79.96 -21.5 43.7 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-O 120.715 0.293 . . . . 0.0 111.01 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.05 165.14 17.76 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -176.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -107.08 -0.74 22.68 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.306 177.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.9 p -162.86 159.08 23.42 Favored 'General case' 0 CA--C 1.482 -1.648 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.457 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.28 -24.73 61.39 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 119.016 -1.074 . . . . 0.0 110.344 178.531 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -63.62 -47.31 81.9 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -63.23 -47.98 80.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.785 176.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.414 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -61.85 -45.7 92.66 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 123.156 0.285 . . . . 0.0 110.753 -176.977 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -62.2 -47.01 86.34 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.961 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.547 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 14.6 t60 -57.78 -54.59 45.12 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.408 0.443 . . . . 0.0 111.195 -178.396 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.518 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.5 pp -67.71 -32.11 72.52 Favored 'General case' 0 C--O 1.245 0.833 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -175.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.822 HD21 HD23 ' A' ' 18' ' ' LEU . 1.2 pp -75.65 -31.0 59.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.774 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.554 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -67.23 -34.22 77.0 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.948 176.493 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 10.6 mm-40 -66.8 -44.34 81.48 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.631 0.729 . . . . 0.0 109.318 176.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -42.59 86.45 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.096 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.554 HG22 ' HA ' ' A' ' 69' ' ' ALA . 6.0 tt -65.12 -46.61 90.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 C-N-CA 119.999 -0.681 . . . . 0.0 110.67 -178.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.698 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 59.4 t80 -50.65 -54.23 24.59 Favored 'General case' 0 C--O 1.268 2.043 0 C-N-CA 125.808 1.643 . . . . 0.0 110.764 177.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -63.74 -31.66 72.9 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.705 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.76 -37.57 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.475 177.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.572 ' OE1' ' HB2' ' B' ' 150' ' ' MET . 31.4 mt-30 -68.04 -42.04 81.16 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.832 -177.229 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.698 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.4 OUTLIER -70.24 -30.4 67.46 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 119.199 -1.001 . . . . 0.0 112.205 176.27 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.82 -45.42 89.7 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 176.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.601 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -65.95 -41.2 91.59 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.536 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 16.0 pt-20 -69.86 -41.61 74.62 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.593 -177.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 8.4 pt-20 -65.79 -44.41 85.83 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.308 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.42 ' O ' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -65.18 -42.37 93.72 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.158 -175.952 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.415 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 54.4 ttp180 -77.69 -26.71 50.43 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 120.93 -0.308 . . . . 0.0 110.89 -178.064 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -71.57 -59.55 2.7 Favored 'General case' 0 C--O 1.245 0.848 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.951 -176.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.3 m -157.06 30.85 0.3 Allowed 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -171.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 82' ' ' LYS . 10.1 ptm180 -77.48 -19.25 56.2 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 116.895 -1.922 . . . . 0.0 109.49 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.7 mm? . . . . . 0 C--O 1.243 0.749 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.583 177.936 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.013 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 26.4 m -85.14 86.97 7.34 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 21.7 mmt -93.93 1.69 56.27 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.162 -178.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 104' ' ' SER . . . . . 0.52 ' HA ' ' CD ' ' B' ' 109' ' ' GLN . 7.6 t 66.19 23.94 10.84 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.293 1.437 . . . . 0.0 110.792 176.094 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -82.1 -20.34 38.32 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.281 0.562 . . . . 0.0 110.43 -178.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -76.66 -48.86 17.69 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 121.519 0.676 . . . . 0.0 112.349 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.61 -45.07 1.36 Allowed Glycine 0 C--N 1.273 -2.935 0 N-CA-C 108.852 -1.699 . . . . 0.0 108.852 -175.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -107.84 17.57 22.34 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.136 -0.532 . . . . 0.0 110.244 179.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 109' ' ' GLN . . . . . 0.52 ' CD ' ' HA ' ' B' ' 104' ' ' SER . 5.2 pm0 -57.06 -32.36 66.14 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.645 177.099 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 2.2 t -55.4 -48.73 73.91 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 123.662 0.601 . . . . 0.0 111.221 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 58.5 tp -66.84 -39.75 87.72 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.309 -176.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -70.71 -45.87 64.15 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 120.798 0.332 . . . . 0.0 111.202 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -61.37 -43.51 98.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.655 0.74 . . . . 0.0 109.039 176.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 114' ' ' LEU . . . . . 0.601 HD21 ' HB3' ' A' ' 79' ' ' LEU . 40.6 tp -68.98 -32.31 71.78 Favored 'General case' 0 C--O 1.188 -2.175 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.4 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.4 tp -69.9 -45.41 67.69 Favored 'General case' 0 C--O 1.246 0.907 0 O-C-N 121.88 -0.513 . . . . 0.0 110.412 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 35.7 m -61.56 -33.2 73.44 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.01 177.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 117' ' ' SER . . . . . 0.649 ' O ' ' HG ' ' B' ' 120' ' ' LEU . 19.8 m -77.67 -43.49 31.07 Favored 'General case' 0 CA--C 1.56 1.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.808 176.348 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 6.7 t70 -62.06 -34.26 75.94 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.799 1.24 . . . . 0.0 111.339 -175.06 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 2.6 p -62.12 -12.23 18.42 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -176.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' B' ' 117' ' ' SER . 2.3 pp -87.18 -10.11 53.48 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.266 176.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 27.8 t -76.43 -57.63 3.75 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.593 -176.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 70.71 -53.68 0.66 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.668 1.187 . . . . 0.0 109.37 -171.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 38.0 m -150.32 123.15 8.68 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 175.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -92.78 -165.51 1.35 Allowed 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -153.14 179.03 29.87 Favored Glycine 0 N--CA 1.422 -2.253 0 C-N-CA 120.075 -1.06 . . . . 0.0 112.393 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 135.48 -160.9 24.62 Favored Glycine 0 N--CA 1.425 -2.036 0 N-CA-C 111.777 -0.529 . . . . 0.0 111.777 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -175.63 -178.41 45.43 Favored Glycine 0 C--N 1.299 -1.486 0 N-CA-C 107.379 -2.288 . . . . 0.0 107.379 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 9.9 t -126.32 174.86 8.26 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 118.605 1.202 . . . . 0.0 109.724 -177.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -166.94 168.53 40.36 Favored Glycine 0 N--CA 1.434 -1.444 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -178.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -86.08 -30.34 23.18 Favored Glycine 0 CA--C 1.502 -0.747 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 178.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 101.78 114.64 3.85 Favored Glycine 0 N--CA 1.428 -1.865 0 C-N-CA 121.02 -0.609 . . . . 0.0 112.467 177.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 8.8 m -109.26 95.66 5.78 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 153.16 -108.92 0.39 Allowed Glycine 0 N--CA 1.437 -1.269 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.13 76.22 0.48 Allowed Glycine 0 C--N 1.316 -0.541 0 O-C-N 123.678 0.281 . . . . 0.0 112.583 178.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -167.68 110.35 0.39 Allowed Glycine 0 CA--C 1.492 -1.368 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 69.7 m 66.15 121.8 0.02 OUTLIER 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.312 1.045 . . . . 0.0 111.309 -175.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.514 ' H ' HD23 ' B' ' 137' ' ' LEU . 1.8 pt? -51.82 -46.4 64.29 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -174.094 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 138' ' ' GLU . . . . . 0.405 ' H ' ' CD ' ' B' ' 138' ' ' GLU . 0.1 OUTLIER -83.07 -12.72 56.88 Favored 'General case' 0 C--N 1.288 -2.087 0 O-C-N 121.308 -0.87 . . . . 0.0 112.241 -177.431 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 81.1 m -86.49 -59.46 2.27 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.441 178.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -162.08 113.73 1.67 Allowed 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 121.155 0.502 . . . . 0.0 111.285 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 141' ' ' MET . . . . . 0.407 ' HG3' ' O ' ' B' ' 137' ' ' LEU . 58.0 mtm -102.92 -9.49 19.82 Favored 'General case' 0 C--O 1.188 -2.152 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.834 178.553 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -25.07 -60.25 0.06 Allowed 'General case' 0 N--CA 1.51 2.559 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 -168.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 5.2 p -61.27 -43.57 98.66 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 122.238 1.018 . . . . 0.0 111.128 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 45.9 mm -70.2 -38.33 74.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.837 0 CA-C-N 114.005 -1.452 . . . . 0.0 109.73 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 18.3 mm -54.7 -49.65 66.41 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.923 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.553 175.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -58.69 -65.11 0.71 Allowed 'General case' 0 N--CA 1.43 -1.442 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.308 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 65.3 m -61.97 -54.79 36.87 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -174.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -81.47 -35.59 30.34 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -174.071 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 9.1 tt -96.63 -34.09 11.53 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -170.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 150' ' ' MET . . . . . 0.572 ' HB2' ' OE1' ' A' ' 76' ' ' GLN . 23.1 ptt? -160.24 52.04 0.31 Allowed 'General case' 0 C--O 1.246 0.913 0 C-N-CA 117.408 -1.717 . . . . 0.0 115.247 -176.007 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 83.77 110.73 0.06 Allowed 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 116.575 2.065 . . . . 0.0 116.575 167.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.002 0 C-N-CA 125.847 1.659 . . . . 0.0 107.77 173.158 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 10.0 ptpp? . . . . . 0 N--CA 1.39 -3.466 0 CA-C-O 121.561 0.696 . . . . 0.0 110.553 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.25 -9.74 24.54 Favored Glycine 0 C--O 1.238 0.376 0 CA-C-N 114.391 -1.277 . . . . 0.0 115.158 -174.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.48 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 66.0 p-90 -68.55 -9.13 47.43 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 117.196 0.498 . . . . 0.0 112.067 178.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.41 ' HD2' ' O ' ' A' ' 4' ' ' LYS . 21.7 p80 -58.54 -24.09 59.84 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-O 120.918 0.389 . . . . 0.0 111.797 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.18 -10.6 59.71 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.171 0.51 . . . . 0.0 110.406 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -105.47 10.88 33.1 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.398 0.618 . . . . 0.0 110.53 -176.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.49 HG23 HD12 ' A' ' 14' ' ' LEU . 7.5 p -139.86 128.57 27.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 p -106.66 162.09 14.06 Favored 'General case' 0 CA--C 1.473 -1.986 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.482 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 0.8 OUTLIER -53.63 -41.58 66.86 Favored 'General case' 0 N--CA 1.422 -1.845 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.596 176.324 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.572 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 6.2 t70 -58.69 -40.85 84.82 Favored 'General case' 0 C--O 1.203 -1.394 0 O-C-N 122.951 0.157 . . . . 0.0 111.225 178.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.49 HD12 HG23 ' A' ' 10' ' ' VAL . 3.1 tm? -69.3 -50.15 49.4 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -175.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.491 ' O ' HG23 ' A' ' 19' ' ' VAL . 13.4 ptm180 -63.79 -46.15 86.5 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.623 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.7 t -67.48 -26.66 66.48 Favored 'General case' 0 CA--C 1.556 1.186 0 CA-C-O 121.033 0.444 . . . . 0.0 110.37 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.572 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 12.3 t60 -68.1 -49.41 61.33 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.627 HD23 HD21 ' A' ' 68' ' ' LEU . 1.2 mp -60.25 -49.55 77.15 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.524 176.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.535 HG13 ' CB ' ' A' ' 47' ' ' ALA . 21.4 t -52.13 -43.3 37.82 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.765 0 C-N-CA 124.581 1.153 . . . . 0.0 109.034 177.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -58.51 -44.93 89.65 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 122.751 0.42 . . . . 0.0 110.396 177.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.557 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 2.5 mptp? -65.03 -35.57 81.58 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.576 175.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.453 HD21 ' HZ1' ' A' ' 71' ' ' LYS . 9.0 mp -55.5 -44.72 76.84 Favored 'General case' 0 CA--C 1.476 -1.897 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.816 176.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.63 HG11 ' HE1' ' A' ' 40' ' ' MET . 78.6 t -58.77 -47.15 90.06 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.919 0 O-C-N 124.134 0.896 . . . . 0.0 110.688 174.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -56.86 -33.76 67.14 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.986 0.422 . . . . 0.0 111.869 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.87 -45.7 15.14 Favored 'General case' 0 C--O 1.192 -1.943 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 177.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.54 HG22 ' HA ' ' A' ' 23' ' ' VAL . 3.2 tt -71.55 -35.27 55.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 O-C-N 121.105 -0.997 . . . . 0.0 110.218 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -119.2 96.88 50.32 Favored Pre-proline 0 N--CA 1.398 -3.036 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 -179.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.97 96.68 0.1 Allowed 'Trans proline' 0 C--O 1.256 1.408 0 C-N-CA 121.616 1.544 . . . . 0.0 108.444 171.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.7 t -75.81 134.8 71.64 Favored Pre-proline 0 N--CA 1.411 -2.413 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.144 -172.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -73.68 -20.97 19.6 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 122.619 2.213 . . . . 0.0 111.487 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -159.31 144.14 11.45 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 -177.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -57.52 -19.74 38.04 Favored 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 122.512 2.141 . . . . 0.0 114.091 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.43 -11.69 59.91 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 121.122 -0.986 . . . . 0.0 112.162 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.83 -8.1 56.7 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.076 0.941 . . . . 0.0 109.269 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 30.7 mt -90.12 2.1 55.67 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.864 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 36' ' ' LYS . 15.1 ptpt -133.8 23.94 3.96 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 122.448 1.118 . . . . 0.0 108.144 178.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.676 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 25.4 t70 -98.18 176.43 5.74 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 113.778 -1.556 . . . . 0.0 110.269 -175.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.676 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.55 -23.2 61.72 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 123.387 0.675 . . . . 0.0 111.132 178.5 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.528 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 41.9 ttm180 -72.94 -26.38 61.36 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 176.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.797 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.5 tpp -61.07 -38.62 86.87 Favored 'General case' 0 C--O 1.193 -1.87 0 CA-C-N 114.518 -1.219 . . . . 0.0 112.636 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 7.2 pt-20 -59.24 -32.07 69.65 Favored 'General case' 0 C--O 1.204 -1.295 0 C-N-CA 118.886 -1.126 . . . . 0.0 110.757 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -75.46 -46.29 33.44 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 123.839 0.855 . . . . 0.0 110.29 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 68.4 mt -63.82 -47.07 82.3 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.793 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.797 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.5 p -72.16 -28.55 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.938 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.58 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -57.06 -47.35 81.19 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 176.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.536 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 1.6 t80 -61.28 -47.99 83.44 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.833 174.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.535 ' CB ' HG13 ' A' ' 19' ' ' VAL . . . -59.52 -44.2 93.22 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.757 -176.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -62.38 -42.47 99.44 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.433 0.693 . . . . 0.0 111.314 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 55.8 pttt -69.27 -39.72 78.22 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.297 0.57 . . . . 0.0 110.635 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 49.4 t -69.5 -47.8 70.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.002 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.458 ' OE2' HD22 ' A' ' 68' ' ' LEU . 12.6 mm-40 -60.73 -37.54 82.09 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.559 178.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.87 -39.19 97.19 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.54 -0.755 . . . . 0.0 112.082 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.24 -52.84 63.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.807 0.337 . . . . 0.0 110.515 177.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.472 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -68.87 -30.15 68.6 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 179.332 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.44 -47.32 86.63 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 175.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.62 -19.15 55.98 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.298 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.0 t -79.22 -27.83 42.49 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.208 0.528 . . . . 0.0 110.176 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.76 165.29 13.01 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-O 121.627 0.727 . . . . 0.0 112.692 -175.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -116.95 18.41 14.71 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.436 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.8 p -168.45 158.54 9.72 Favored 'General case' 0 CA--C 1.49 -1.34 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 173.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HA ' ' HD1' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -71.85 -30.7 65.72 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.969 177.919 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -58.78 -47.49 84.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.111 -0.949 . . . . 0.0 108.911 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -65.86 -46.41 78.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.392 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.435 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -63.33 -45.07 92.98 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -176.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.434 ' HA ' ' CD2' ' A' ' 68' ' ' LEU . 7.6 t80 -63.55 -39.7 95.09 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.601 178.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -62.7 -55.86 22.94 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.472 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.4 pp -65.35 -33.14 75.27 Favored 'General case' 0 C--O 1.255 1.39 0 CA-C-O 121.598 0.713 . . . . 0.0 111.482 -175.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.627 HD21 HD23 ' A' ' 18' ' ' LEU . 1.4 pp -73.42 -32.41 64.4 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.909 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.527 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -68.44 -33.97 75.14 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.674 178.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -66.1 -43.16 88.05 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.403 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.508 ' NZ ' ' HB2' ' A' ' 68' ' ' LEU . 1.4 pptp? -65.17 -42.67 93.44 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 119.811 -0.756 . . . . 0.0 111.925 179.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.605 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.1 tt -65.94 -40.42 87.37 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.693 0 CA-C-O 121.006 0.432 . . . . 0.0 110.163 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.517 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 62.6 t80 -57.33 -52.86 63.64 Favored 'General case' 0 C--O 1.272 2.261 0 C-N-CA 124.963 1.305 . . . . 0.0 110.495 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -64.38 -33.07 75.0 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.225 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.72 -38.31 81.98 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.992 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.609 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 53.0 mt-30 -69.62 -43.86 71.84 Favored 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.626 -175.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.517 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.2 OUTLIER -70.44 -28.24 64.87 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 118.648 -1.221 . . . . 0.0 112.782 175.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -61.74 -49.41 76.51 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 175.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.4 pp -64.84 -40.45 95.2 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.76 -176.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.432 ' N ' HD12 ' A' ' 79' ' ' LEU . 45.9 mt-10 -62.68 -50.42 71.22 Favored 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 123.665 0.603 . . . . 0.0 112.211 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.5 pt-20 -72.57 -32.09 65.75 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 119.708 -0.797 . . . . 0.0 112.787 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.54 -35.23 80.23 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 . . . . . 0 N--CA 1.447 -0.607 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.027 178.301 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.212 -0.9 0 CA-C-O 120.619 0.247 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' B' ' 118' ' ' ASP . 51.6 tp -67.4 -41.85 84.25 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 175.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.8 m -65.71 -39.46 91.22 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.27 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.5 m -77.37 -20.65 54.45 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.386 0.613 . . . . 0.0 111.375 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' B' ' 115' ' ' LEU . 9.8 t70 . . . . . 0 C--N 1.317 -0.811 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 175.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 26.3 ttp . . . . . 0 C--O 1.201 -1.473 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -14.82 -71.98 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 127.22 2.208 . . . . 0.0 116.711 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 20.2 m -70.5 -38.8 74.36 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 122.01 -0.432 . . . . 0.0 111.623 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 66.8 mt -66.88 -45.95 86.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.406 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 14.7 tt -66.04 -37.21 79.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.349 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -61.29 -52.84 63.02 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.6 t -68.63 -54.06 18.74 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -176.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -80.96 -37.4 29.46 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -173.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.527 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 52.7 tp . . . . . 0 N--CA 1.471 0.608 0 CA-C-N 118.205 0.457 . . . . 0.0 109.932 178.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.513 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 39.1 mttp . . . . . 0 N--CA 1.433 -1.322 0 CA-C-O 120.86 0.362 . . . . 0.0 110.061 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -67.22 -17.42 68.13 Favored Glycine 0 C--N 1.317 -0.495 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.497 -176.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.513 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 63.1 p-90 -68.19 -10.25 52.96 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.48 -17.61 59.96 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -81.67 -9.46 59.65 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 121.162 0.506 . . . . 0.0 109.989 177.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.434 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 53.5 m-70 -101.63 9.66 40.9 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.91 -178.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.6 p -140.05 110.86 4.19 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.732 0 CA-C-O 122.24 1.019 . . . . 0.0 109.429 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 m -88.38 161.29 17.17 Favored 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.095 -0.957 . . . . 0.0 108.705 -176.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -36.9 64.83 Favored 'General case' 0 C--O 1.195 -1.81 0 C-N-CA 122.891 0.477 . . . . 0.0 110.17 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -52.09 -46.43 65.22 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 123.919 0.888 . . . . 0.0 113.134 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.505 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -70.19 -50.64 38.08 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -174.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.543 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.1 ptm180 -64.17 -44.65 91.42 Favored 'General case' 0 N--CA 1.421 -1.891 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.12 -177.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.0 t -63.66 -30.48 71.58 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 122.966 0.507 . . . . 0.0 110.546 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -65.31 -47.22 77.35 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.817 HD23 HD21 ' A' ' 68' ' ' LEU . 5.4 mp -65.61 -40.92 93.15 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.476 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.2 t -58.84 -46.4 91.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 124.636 1.174 . . . . 0.0 110.166 176.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -57.32 -51.91 67.49 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.326 177.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.2 mttp -62.26 -40.33 95.83 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.692 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.523 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -51.84 -52.61 48.1 Favored 'General case' 0 CA--C 1.508 -0.667 0 C-N-CA 124.401 1.08 . . . . 0.0 108.922 176.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.467 HG13 ' HB3' ' A' ' 43' ' ' LEU . 39.4 t -54.1 -51.22 48.8 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.207 0 O-C-N 124.308 1.005 . . . . 0.0 110.752 176.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -56.92 -34.57 68.08 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -176.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.37 -46.76 14.19 Favored 'General case' 0 C--O 1.195 -1.795 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.74 177.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.616 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.84 -26.49 17.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 CA-C-O 122.063 0.935 . . . . 0.0 110.95 -174.073 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.616 ' CD2' HG23 ' A' ' 26' ' ' ILE . 69.4 m-85 -124.94 91.66 49.0 Favored Pre-proline 0 C--N 1.283 -2.305 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.129 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -65.68 102.02 0.49 Allowed 'Trans proline' 0 C--O 1.247 0.943 0 C-N-CA 122.134 1.89 . . . . 0.0 111.001 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.451 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 12.7 t -77.23 136.99 64.83 Favored Pre-proline 0 N--CA 1.423 -1.792 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.227 -176.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -76.5 -27.49 7.63 Favored 'Trans proline' 0 C--O 1.244 0.783 0 C-N-CA 122.974 2.449 . . . . 0.0 112.154 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -147.52 149.19 33.42 Favored Pre-proline 0 CA--C 1.485 -1.528 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.29 -9.91 26.85 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 121.626 1.551 . . . . 0.0 111.702 177.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.24 -10.44 57.69 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.15 0.5 . . . . 0.0 111.522 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.451 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -81.11 -6.56 58.97 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.936 0.874 . . . . 0.0 109.025 176.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.553 ' HA ' ' HE3' ' A' ' 40' ' ' MET . 21.8 mt -90.85 5.55 48.03 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.366 -178.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -133.48 17.71 3.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.107 0.956 . . . . 0.0 108.926 177.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.656 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 15.3 t70 -88.54 176.69 7.04 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.974 -176.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.656 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.8 OUTLIER -71.29 -26.72 62.99 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 173.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.584 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 32.2 ttm180 -59.4 -36.05 75.11 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.933 -1.03 . . . . 0.0 109.391 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.553 ' HE3' ' HA ' ' A' ' 35' ' ' LEU . 8.6 tpp -58.75 -37.89 77.22 Favored 'General case' 0 C--O 1.212 -0.905 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.869 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -66.76 -27.83 67.92 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 117.947 -1.501 . . . . 0.0 110.072 -178.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -75.03 -42.06 57.97 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.522 0.729 . . . . 0.0 110.208 176.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.589 HD22 ' CG ' ' A' ' 27' ' ' PHE . 28.3 mt -61.92 -53.57 53.95 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.878 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.416 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.0 p -70.22 -27.79 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.597 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.267 -178.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.67 84.96 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.938 0.399 . . . . 0.0 110.199 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.54 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -60.29 -44.7 95.16 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.889 175.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.3 -41.93 97.82 Favored 'General case' 0 C--O 1.199 -1.58 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.485 -177.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.5 mttm -64.65 -44.22 91.14 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 176.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 58.2 pttt -63.8 -40.55 96.92 Favored 'General case' 0 C--O 1.256 1.424 0 CA-C-O 121.544 0.688 . . . . 0.0 110.373 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.457 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 48.7 t -70.74 -45.32 74.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 114.933 -1.031 . . . . 0.0 110.694 178.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.408 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.9 tm-20 -56.98 -46.2 82.41 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.75 -37.05 92.95 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.624 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -61.04 -52.98 62.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.012 0.434 . . . . 0.0 110.592 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.554 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -69.85 -27.75 65.1 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 179.04 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -62.83 -49.5 74.67 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 175.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -74.5 -19.51 60.34 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.7 t -79.65 -20.08 47.58 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 120.717 0.294 . . . . 0.0 110.78 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.52 161.67 13.55 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -174.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -107.86 5.6 26.6 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.47 -1.241 . . . . 0.0 110.53 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 75.5 p -164.02 159.51 20.74 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.434 ' NE ' ' HB3' ' A' ' 9' ' ' HIS . 0.2 OUTLIER -72.51 -24.07 61.1 Favored 'General case' 0 C--O 1.197 -1.677 0 C-N-CA 118.91 -1.116 . . . . 0.0 109.818 177.746 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -66.02 -44.46 84.63 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -66.3 -46.34 77.29 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.282 175.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.409 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.1 -45.36 89.01 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 123.157 0.286 . . . . 0.0 110.54 -177.474 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -44.09 95.0 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 123.762 0.664 . . . . 0.0 110.566 177.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.42 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 15.4 t-80 -64.75 -50.98 64.74 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.0 pp -67.3 -32.2 73.03 Favored 'General case' 0 C--O 1.252 1.198 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.218 -174.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.817 HD21 HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -75.95 -31.48 59.08 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 178.268 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.491 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -64.51 -35.28 80.45 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.798 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 12.6 mt-10 -72.17 -40.55 67.89 Favored 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 120.304 -0.558 . . . . 0.0 109.985 179.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.75 -38.87 87.5 Favored 'General case' 0 C--O 1.212 -0.894 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.667 -179.103 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.623 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -68.69 -42.94 83.39 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.291 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -57.22 -51.75 68.07 Favored 'General case' 0 C--O 1.275 2.432 0 C-N-CA 124.64 1.176 . . . . 0.0 110.793 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.9 -36.9 85.87 Favored 'General case' 0 C--O 1.21 -0.988 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.674 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.3 mp -61.36 -39.82 84.06 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 O-C-N 123.451 0.469 . . . . 0.0 110.182 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.623 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 50.2 mt-30 -64.18 -49.9 70.23 Favored 'General case' 0 CA--C 1.496 -1.1 0 O-C-N 123.636 0.585 . . . . 0.0 110.286 -177.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.451 ' H ' ' HG2' ' A' ' 77' ' ' LYS . 0.8 OUTLIER -73.28 -28.22 61.99 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 118.786 -1.166 . . . . 0.0 113.922 179.377 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -64.58 -47.79 77.38 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.0 pp -64.93 -38.99 92.8 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.58 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 52.4 mt-10 -58.49 -54.45 46.94 Favored 'General case' 0 CA--C 1.49 -1.332 0 O-C-N 123.992 0.807 . . . . 0.0 110.302 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 10.6 pt-20 -68.39 -39.05 81.86 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 120.312 -0.555 . . . . 0.0 112.127 -175.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.456 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -66.13 -34.17 77.45 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.687 -178.828 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 . . . . . 0 C--N 1.314 -0.97 0 CA-C-O 121.279 0.562 . . . . 0.0 110.095 177.993 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 1.2 mm? . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 33.5 tp -65.38 -45.87 82.35 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 122.208 -0.307 . . . . 0.0 110.379 175.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 28.7 m -66.65 -39.74 88.36 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.149 0.5 . . . . 0.0 110.332 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 30.3 m -73.19 -22.5 60.45 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.426 0.631 . . . . 0.0 111.944 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 40.1 t0 . . . . . 0 C--N 1.313 -1.004 0 CA-C-O 122.106 0.955 . . . . 0.0 108.614 174.287 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 45.3 ttp . . . . . 0 C--O 1.21 -0.986 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -35.94 -65.96 0.23 Allowed 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.0 p -66.12 -33.92 76.88 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 121.243 0.544 . . . . 0.0 112.103 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 51.2 mm -67.0 -49.59 72.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.975 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.448 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 21.2 tt -69.7 -31.19 47.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.163 -177.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -57.81 -65.31 0.66 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 20.0 p -67.2 -45.6 76.38 Favored 'General case' 0 C--O 1.247 0.96 0 CA-C-N 114.441 -1.254 . . . . 0.0 113.517 -174.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -80.44 -34.41 36.09 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.491 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 9.1 tt . . . . . 0 C--N 1.313 -0.997 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -170.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.468 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 76.9 mttt . . . . . 0 N--CA 1.421 -1.89 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.01 -21.39 31.03 Favored Glycine 0 C--N 1.321 -0.252 0 CA-C-N 115.243 -0.89 . . . . 0.0 114.947 -176.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.468 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 55.7 p-90 -64.13 -14.69 56.69 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 117.365 0.583 . . . . 0.0 112.368 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -61.29 -12.88 15.21 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 176.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -81.76 -16.85 49.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.66 0.743 . . . . 0.0 109.833 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -105.32 18.69 21.86 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.825 -171.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.67 130.32 9.67 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.831 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.2 m -105.28 162.88 13.04 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 -177.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.15 -36.26 72.72 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 120.792 0.329 . . . . 0.0 110.406 177.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -58.41 -41.33 84.72 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.828 -0.623 . . . . 0.0 112.123 178.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.54 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -68.3 -52.06 37.89 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 -175.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.575 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.4 ptm180 -63.97 -43.84 94.56 Favored 'General case' 0 N--CA 1.415 -2.2 0 CA-C-N 114.301 -1.318 . . . . 0.0 112.849 -176.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 t -66.71 -28.3 68.32 Favored 'General case' 0 N--CA 1.44 -0.962 0 N-CA-C 110.237 -0.282 . . . . 0.0 110.237 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.7 t60 -68.02 -41.98 81.35 Favored 'General case' 0 C--O 1.241 0.644 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.78 HD23 HD21 ' A' ' 68' ' ' LEU . 5.0 mp -67.02 -40.67 87.29 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.173 -0.922 . . . . 0.0 109.704 177.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 15' ' ' ARG . 76.6 t -56.85 -47.9 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.049 0.94 . . . . 0.0 109.793 174.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.483 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 23.1 t-80 -54.85 -52.23 63.41 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.367 177.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.4 mttp -61.77 -39.76 92.8 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.428 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.479 ' O ' HG22 ' A' ' 26' ' ' ILE . 8.8 mt -52.37 -52.55 52.89 Favored 'General case' 0 CA--C 1.506 -0.748 0 C-N-CA 123.463 0.705 . . . . 0.0 111.0 175.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.2 t -54.92 -48.7 74.51 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.373 0 O-C-N 124.0 0.812 . . . . 0.0 109.869 176.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 40.2 mt-30 -57.55 -34.65 69.38 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -175.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.15 -45.54 15.0 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 176.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.531 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.6 -23.42 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 121.988 0.899 . . . . 0.0 110.439 -174.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD2' HG23 ' A' ' 26' ' ' ILE . 66.1 m-85 -133.2 84.62 47.22 Favored Pre-proline 0 C--N 1.284 -2.242 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.18 106.46 0.3 Allowed 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.636 2.224 . . . . 0.0 111.194 -177.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.408 HG21 HD21 ' A' ' 35' ' ' LEU . 7.4 t -83.73 137.16 41.34 Favored Pre-proline 0 N--CA 1.425 -1.709 0 CA-C-O 121.124 0.488 . . . . 0.0 111.625 -172.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -80.74 -19.93 8.21 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.787 2.325 . . . . 0.0 112.315 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -158.53 159.06 29.93 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.705 -176.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.568 ' HA ' HD12 ' A' ' 35' ' ' LEU . 58.6 Cg_endo -77.17 -1.46 11.63 Favored 'Trans proline' 0 N--CA 1.442 -1.504 0 C-N-CA 121.446 1.431 . . . . 0.0 113.876 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -95.34 -17.12 21.87 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.692 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.9 -16.05 63.66 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 122.189 0.995 . . . . 0.0 108.845 172.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 32' ' ' PRO . 33.3 mt -87.36 1.23 53.92 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.276 -1.329 . . . . 0.0 111.374 -179.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -133.04 24.16 4.22 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-O 122.407 1.099 . . . . 0.0 108.888 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.58 ' O ' ' HB3' ' A' ' 40' ' ' MET . 25.6 t70 -82.36 170.92 14.78 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 114.053 -1.43 . . . . 0.0 108.151 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.552 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.81 -25.5 62.89 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-O 121.903 0.859 . . . . 0.0 109.743 179.115 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.541 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 21.4 ttp180 -77.4 -15.78 59.18 Favored 'General case' 0 C--O 1.251 1.139 0 C-N-CA 124.442 1.097 . . . . 0.0 110.204 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.615 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.5 tpp -59.55 -32.94 70.8 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.068 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HA ' HG12 ' A' ' 44' ' ' VAL . 0.5 OUTLIER -62.32 -33.55 74.91 Favored 'General case' 0 C--O 1.184 -2.349 0 C-N-CA 119.003 -1.079 . . . . 0.0 110.595 -179.771 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.429 HD22 HD23 ' A' ' 43' ' ' LEU . 5.1 t30 -70.99 -46.14 62.79 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 121.266 0.555 . . . . 0.0 109.556 178.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 18.7 mt -59.36 -51.09 71.4 Favored 'General case' 0 C--O 1.245 0.868 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.11 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.615 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -72.86 -28.59 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.058 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.728 -177.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.37 -46.42 90.25 Favored 'General case' 0 C--O 1.246 0.896 0 N-CA-C 109.794 -0.446 . . . . 0.0 109.794 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.5 t80 -59.58 -47.04 87.12 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.773 173.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.78 -41.63 95.95 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.771 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -63.02 -46.27 88.37 Favored 'General case' 0 C--O 1.216 -0.676 0 O-C-N 123.46 0.475 . . . . 0.0 111.613 176.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.4 pttp -64.37 -38.81 92.36 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-O 121.631 0.729 . . . . 0.0 110.885 -176.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.427 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 51.7 t -72.1 -45.26 63.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.551 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.433 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.8 tm-20 -57.07 -45.33 83.36 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 177.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.02 -40.06 95.05 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.273 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -61.12 -52.93 62.82 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.173 0.511 . . . . 0.0 111.195 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.437 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -67.4 -30.35 70.1 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 178.475 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -63.06 -53.76 48.73 Favored 'General case' 0 C--O 1.196 -1.759 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -73.04 -20.97 60.88 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 122.048 -0.407 . . . . 0.0 111.463 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.8 t -77.67 -42.49 34.47 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.2 162.39 28.46 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -173.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -102.89 4.53 37.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.147 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.421 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 66.7 p -160.17 160.04 32.39 Favored 'General case' 0 CA--C 1.488 -1.439 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.07 -24.26 61.48 Favored 'General case' 0 C--O 1.206 -1.215 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.152 176.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -68.07 -47.81 67.27 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -61.45 -43.92 98.02 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.462 176.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -48.38 77.03 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 123.36 0.412 . . . . 0.0 110.389 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.528 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 0.3 OUTLIER -60.58 -45.93 92.11 Favored 'General case' 0 N--CA 1.433 -1.311 0 O-C-N 123.882 0.739 . . . . 0.0 110.32 177.785 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.654 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 20.4 m80 -67.41 -42.74 82.78 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -178.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.437 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.0 pp -71.27 -31.63 67.72 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.56 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.78 HD21 HD23 ' A' ' 18' ' ' LEU . 1.7 pp -73.83 -32.85 63.88 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 178.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.484 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.83 -37.31 87.18 Favored 'General case' 0 C--O 1.197 -1.703 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.225 175.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.654 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 69.9 mm-40 -64.16 -43.89 93.76 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-O 121.824 0.821 . . . . 0.0 110.25 177.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -69.88 -41.05 75.28 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.4 -177.469 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.501 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.8 tt -68.5 -34.66 66.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.43 0.634 . . . . 0.0 109.467 -178.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.581 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 39.1 t80 -57.49 -54.4 47.26 Favored 'General case' 0 C--O 1.261 1.682 0 C-N-CA 125.8 1.64 . . . . 0.0 109.318 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.2 ptpt -64.75 -33.84 76.93 Favored 'General case' 0 C--O 1.207 -1.157 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.376 -178.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.436 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -63.61 -38.8 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-O 120.652 0.263 . . . . 0.0 110.858 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.552 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 37.6 mt-30 -69.07 -44.36 72.73 Favored 'General case' 0 CA--C 1.501 -0.942 0 C-N-CA 120.535 -0.466 . . . . 0.0 111.294 -177.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.581 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -72.15 -28.19 63.08 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 118.42 -1.312 . . . . 0.0 112.005 177.453 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.86 -49.04 77.85 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 176.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.65 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -64.15 -42.3 96.81 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.879 -178.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.55 -45.13 95.46 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -75.39 -32.72 60.87 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.837 -0.745 . . . . 0.0 111.936 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.85 -38.26 88.4 Favored 'General case' 0 C--N 1.348 0.504 0 CA-C-O 121.01 0.433 . . . . 0.0 110.133 -178.852 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.44 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 48.3 ttp180 . . . . . 0 N--CA 1.427 -1.617 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.608 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.65 HD21 ' HB3' ' A' ' 79' ' ' LEU . 26.5 tp . . . . . 0 N--CA 1.434 -1.24 0 CA-C-O 120.546 0.212 . . . . 0.0 111.388 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 63.3 tp -70.45 -41.67 72.52 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 172.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.6 m -72.24 -42.58 65.51 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.954 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.8 m -62.27 -34.6 76.88 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.245 0.545 . . . . 0.0 110.489 176.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 13.8 t70 . . . . . 0 N--CA 1.471 0.575 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 23.5 ptt? . . . . . 0 N--CA 1.445 -0.679 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.469 ' HA ' ' CG2' ' B' ' 145' ' ' ILE 0.339 38.6 mt-10 -37.19 -47.16 0.76 Allowed 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -168.012 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.6 m -64.26 -52.42 58.78 Favored 'General case' 0 C--O 1.267 1.991 0 CA-C-O 121.705 0.764 . . . . 0.0 110.169 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 46.3 mm -64.53 -51.54 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.098 -176.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.528 ' HA ' ' OH ' ' A' ' 65' ' ' TYR . 10.7 tt -58.76 -43.74 88.63 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.688 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.747 -177.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -61.59 -45.7 93.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.264 0.078 . . . . 0.0 110.852 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 20.8 p -66.54 -32.24 73.47 Favored 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -80.73 -31.36 36.06 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.283 0.563 . . . . 0.0 110.308 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 12.8 tp . . . . . 0 C--N 1.311 -1.106 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.673 -175.944 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HD3' ' NE1' ' A' ' 6' ' ' TRP . 14.3 ptpt . . . . . 0 N--CA 1.416 -2.171 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.94 -25.9 32.26 Favored Glycine 0 C--O 1.239 0.439 0 CA-C-N 114.783 -1.099 . . . . 0.0 115.11 -172.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.48 ' NE1' ' HD3' ' A' ' 4' ' ' LYS . 67.3 p-90 -66.72 -4.66 9.48 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -64.47 -21.44 66.66 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.07 0.462 . . . . 0.0 111.081 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -89.33 0.14 57.03 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.776 0.798 . . . . 0.0 110.065 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 -106.4 6.53 30.46 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.388 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.42 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.3 p -136.02 111.08 11.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 CA-C-N 115.312 -0.858 . . . . 0.0 108.955 -178.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 m -81.72 152.85 26.84 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.834 -175.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.96 70.58 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.309 177.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -63.57 -33.88 76.57 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.537 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.0 tm? -70.6 -52.25 22.72 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -176.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.551 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -65.03 -42.73 94.09 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.843 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.7 t -63.99 -31.26 72.38 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 178.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.538 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 31.0 t60 -69.66 -40.19 76.59 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.204 0.526 . . . . 0.0 109.714 178.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.703 HD23 HD21 ' A' ' 68' ' ' LEU . 5.5 mp -65.57 -41.34 93.04 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.997 176.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 15' ' ' ARG . 69.8 t -57.13 -49.04 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 123.822 0.849 . . . . 0.0 109.628 174.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -52.28 -52.4 52.98 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.869 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 58.0 mttm -63.79 -41.06 98.0 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.805 178.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.536 ' O ' HG22 ' A' ' 26' ' ' ILE . 15.1 mt -50.7 -51.94 44.91 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 123.966 0.791 . . . . 0.0 109.949 176.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.719 HG11 ' HE1' ' A' ' 40' ' ' MET . 72.5 t -56.89 -51.04 73.12 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.697 0 O-C-N 124.206 0.941 . . . . 0.0 111.423 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -54.02 -37.64 64.3 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.508 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -82.17 -46.65 13.5 Favored 'General case' 0 C--O 1.21 -0.997 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 177.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.556 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.51 -22.21 16.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.66 0 CA-C-O 122.051 0.929 . . . . 0.0 110.102 -174.345 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.576 ' CG ' HD22 ' A' ' 43' ' ' LEU . 58.4 m-85 -130.58 84.1 60.08 Favored Pre-proline 0 C--N 1.275 -2.652 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.631 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.415 ' HG2' ' HA ' ' B' ' 118' ' ' ASP . 19.8 Cg_endo -59.25 107.01 0.33 Allowed 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.865 1.71 . . . . 0.0 109.874 179.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.2 t -84.42 149.08 54.1 Favored Pre-proline 0 C--N 1.29 -1.993 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.055 -174.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.56 -28.61 14.19 Favored 'Trans proline' 0 C--O 1.243 0.737 0 C-N-CA 122.404 2.069 . . . . 0.0 111.427 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -155.7 161.06 30.27 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.243 -177.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 35' ' ' LEU . 57.0 Cg_endo -78.72 -3.5 13.33 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 121.931 1.754 . . . . 0.0 114.623 -177.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.55 ' O ' ' HG2' ' A' ' 36' ' ' LYS . . . -96.89 -16.97 20.45 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.245 0.545 . . . . 0.0 109.868 177.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.621 ' HA ' ' OD2' ' A' ' 37' ' ' ASP . . . -66.06 -17.02 64.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 122.466 1.127 . . . . 0.0 108.828 173.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 32' ' ' PRO . 55.8 mt -80.81 5.42 16.02 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 113.458 -1.701 . . . . 0.0 111.056 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 15.6 ptpt -133.82 6.19 3.69 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.179 0.514 . . . . 0.0 110.722 173.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.621 ' OD2' ' HA ' ' A' ' 34' ' ' ALA . 69.6 m-20 -85.25 179.71 7.16 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.826 178.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.488 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.4 OUTLIER -59.18 -24.83 63.41 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.307 0.643 . . . . 0.0 111.836 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.638 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 22.6 tpp180 -65.27 -35.65 81.69 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.848 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.1 tpp -59.59 -35.07 73.59 Favored 'General case' 0 C--O 1.191 -1.986 0 CA-C-N 114.715 -1.129 . . . . 0.0 112.693 -177.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 13.9 pt-20 -60.92 -32.92 72.39 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.475 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.426 HD22 HD23 ' A' ' 43' ' ' LEU . 5.5 t30 -78.57 -43.89 25.48 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.18 0.514 . . . . 0.0 110.133 178.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 16.5 mt -60.77 -50.95 71.4 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.583 -178.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.848 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.5 p -68.84 -32.95 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.59 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.049 -179.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.13 -46.42 82.68 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-O 120.759 0.314 . . . . 0.0 110.552 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.8 t80 -61.67 -46.75 88.4 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.044 174.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.73 -37.84 88.16 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 120.319 -0.553 . . . . 0.0 111.543 -176.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 91.8 mttt -66.74 -43.1 85.09 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 123.232 0.613 . . . . 0.0 111.501 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.9 pttp -67.27 -37.29 83.2 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.549 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 37.3 t -71.26 -48.0 56.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.603 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.3 tm-20 -57.55 -48.25 79.81 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 123.428 0.691 . . . . 0.0 109.584 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.41 -35.17 91.31 Favored Glycine 0 C--N 1.332 0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.308 178.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -63.52 -52.51 60.89 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 122.729 0.412 . . . . 0.0 110.273 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.461 ' H ' ' HG2' ' A' ' 54' ' ' MET . 0.0 OUTLIER -67.86 -30.61 70.03 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 177.883 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -62.6 -41.48 99.0 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 175.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -78.81 -21.84 47.11 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.862 178.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.5 t -84.48 -29.46 26.01 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-O 121.164 0.507 . . . . 0.0 110.869 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.95 166.67 13.77 Favored 'General case' 0 C--O 1.245 0.84 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -176.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -116.72 6.93 13.35 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.416 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.6 p -157.99 158.34 34.71 Favored 'General case' 0 CA--C 1.475 -1.918 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 173.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.42 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.4 -26.21 61.79 Favored 'General case' 0 C--O 1.2 -1.522 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.926 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -66.18 -45.08 82.13 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -62.14 -46.78 87.49 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.15 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.41 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -65.28 -47.4 76.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.816 -0.175 . . . . 0.0 110.928 -177.335 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -58.96 -46.09 88.9 Favored 'General case' 0 C--O 1.208 -1.11 0 C-N-CA 123.459 0.704 . . . . 0.0 110.091 176.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -64.28 -49.61 71.15 Favored 'General case' 0 C--O 1.213 -0.84 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.445 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.3 pp -68.09 -32.51 72.87 Favored 'General case' 0 C--O 1.255 1.395 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.609 -176.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.703 HD21 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -74.47 -35.05 63.27 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.506 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -62.8 -37.46 86.79 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.535 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -64.3 -44.51 91.4 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.954 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -42.23 79.33 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.859 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 7.0 tt -63.49 -44.14 98.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.564 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.444 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 35.7 t80 -55.3 -54.19 46.69 Favored 'General case' 0 C--O 1.259 1.582 0 C-N-CA 124.97 1.308 . . . . 0.0 110.035 -179.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -65.12 -32.02 73.51 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.597 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -67.77 -40.94 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 122.96 0.504 . . . . 0.0 111.189 178.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.542 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 43.2 mt-30 -66.21 -39.56 89.71 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.379 0.609 . . . . 0.0 109.425 -179.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.679 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS 0.267 0.0 OUTLIER -71.86 -27.21 62.72 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 174.134 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.514 ' OE1' HD23 ' B' ' 114' ' ' LEU . 2.2 tm-20 -64.9 -52.21 57.71 Favored 'General case' 0 C--N 1.309 -1.196 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.455 ' HA ' ' CG ' ' A' ' 82' ' ' LYS . 4.7 pp -62.16 -37.03 83.64 Favored 'General case' 0 C--O 1.248 1.015 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.142 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.599 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 12.9 pt-20 -65.93 -44.89 83.76 Favored 'General case' 0 N--CA 1.439 -1.0 0 C-N-CA 119.791 -0.763 . . . . 0.0 110.606 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -70.61 -43.34 69.5 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.54 -177.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.455 ' CG ' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -62.19 -46.35 89.31 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -177.255 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 25.5 ttm180 . . . . . 0 N--CA 1.429 -1.5 0 O-C-N 123.359 0.412 . . . . 0.0 110.594 -177.799 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.514 HD23 ' OE1' ' A' ' 78' ' ' GLU . 26.6 tp . . . . . 0 C--O 1.183 -2.433 0 CA-C-O 119.345 -0.36 . . . . 0.0 111.563 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 35.8 tp -70.96 -36.05 72.41 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-N 118.926 0.785 . . . . 0.0 109.995 175.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 31.5 m -64.93 -36.13 83.4 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 16.1 m -76.66 -36.3 57.42 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.972 176.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.415 ' HA ' ' HG2' ' A' ' 28' ' ' PRO . 29.5 t70 . . . . . 0 C--N 1.315 -0.911 0 C-N-CA 125.327 1.451 . . . . 0.0 110.491 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 24.4 ptp . . . . . 0 C--O 1.197 -1.661 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.435 ' H ' ' CD ' ' B' ' 142' ' ' GLU . 1.1 mp0 -17.98 -70.28 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 127.524 2.33 . . . . 0.0 115.84 -172.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 50.1 m -72.94 -38.66 66.73 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 120.94 0.4 . . . . 0.0 111.373 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 78.9 mt -65.97 -53.4 38.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.196 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 19.8 tt -65.55 -31.69 54.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.139 -177.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -59.93 -51.22 70.62 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 174.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.8 p -69.41 -39.33 77.99 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -80.95 -52.91 6.92 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.506 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 7.3 tt . . . . . 0 C--N 1.303 -1.437 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.869 -171.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.6 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 15.6 ptpt . . . . . 0 N--CA 1.422 -1.85 0 CA-C-O 121.98 0.895 . . . . 0.0 111.883 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.19 -2.97 10.24 Favored Glycine 0 CA--C 1.508 -0.355 0 CA-C-N 114.197 -1.365 . . . . 0.0 114.907 -175.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.6 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 63.7 p-90 -68.35 -11.83 60.17 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 117.391 0.595 . . . . 0.0 110.771 176.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -60.75 -25.15 66.28 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.237 0.541 . . . . 0.0 110.345 176.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -77.69 -4.51 46.49 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 121.141 0.496 . . . . 0.0 110.64 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.7 m-70 -111.61 10.6 21.15 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 121.167 0.508 . . . . 0.0 110.664 -177.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.7 p -138.71 110.39 5.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 CA-C-O 122.043 0.925 . . . . 0.0 109.261 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.9 m -81.3 156.23 25.63 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.031 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -37.96 55.09 Favored 'General case' 0 C--O 1.204 -1.338 0 C-N-CA 124.23 1.012 . . . . 0.0 110.509 176.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -60.54 -38.42 84.43 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.542 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -69.87 -50.0 46.8 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 -176.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.571 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.9 OUTLIER -65.23 -46.39 80.81 Favored 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 114.362 -1.29 . . . . 0.0 112.888 -177.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.8 t -66.4 -26.7 67.37 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.015 0.436 . . . . 0.0 110.03 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.438 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 10.2 t60 -64.8 -49.81 69.23 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 176.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.738 HD23 HD21 ' A' ' 68' ' ' LEU . 4.5 mp -63.7 -39.46 94.37 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.197 177.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 15' ' ' ARG . 65.8 t -58.35 -51.85 66.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 124.077 0.951 . . . . 0.0 110.897 175.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -54.28 -45.42 72.47 Favored 'General case' 0 C--O 1.254 1.303 0 C-N-CA 123.705 0.802 . . . . 0.0 110.482 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -66.78 -39.56 87.85 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.901 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.486 ' O ' HG22 ' A' ' 26' ' ' ILE . 30.1 mt -51.14 -50.58 58.62 Favored 'General case' 0 CA--C 1.5 -0.977 0 O-C-N 123.76 0.663 . . . . 0.0 109.963 175.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.541 HG13 ' HB3' ' A' ' 43' ' ' LEU . 73.8 t -54.19 -53.47 28.79 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.89 0 O-C-N 124.285 0.99 . . . . 0.0 110.353 176.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -51.91 -37.41 52.41 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -178.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.16 -46.31 13.95 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 178.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.486 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -75.92 -21.97 15.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.856 0.836 . . . . 0.0 110.422 -174.256 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.481 ' CD2' HG23 ' A' ' 26' ' ' ILE . 42.2 m-85 -133.98 89.72 28.51 Favored Pre-proline 0 N--CA 1.412 -2.333 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.412 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -59.76 100.47 0.14 Allowed 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.019 1.813 . . . . 0.0 110.383 176.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -67.84 138.04 92.79 Favored Pre-proline 0 N--CA 1.428 -1.545 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.762 -172.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -64.34 -30.38 63.29 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.825 2.35 . . . . 0.0 111.832 178.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -161.79 150.03 12.46 Favored Pre-proline 0 CA--C 1.503 -0.838 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 -176.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.434 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 7.6 Cg_endo -54.73 -25.05 40.44 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 122.579 2.186 . . . . 0.0 113.717 174.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.96 -11.72 59.84 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 121.21 -0.931 . . . . 0.0 112.029 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.69 -9.38 59.8 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.761 0.791 . . . . 0.0 109.258 177.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.434 ' CD1' ' HA ' ' A' ' 32' ' ' PRO . 22.6 mt -87.84 -0.07 56.48 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.711 -178.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.411 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -133.86 15.3 3.94 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.967 0.889 . . . . 0.0 110.205 178.027 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.644 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 30.9 t70 -94.25 179.73 5.21 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.16 -178.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.644 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.7 -25.15 62.83 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 120.591 0.234 . . . . 0.0 110.75 177.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.642 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 15.4 tpp180 -57.87 -34.65 69.98 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 174.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.749 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.7 tpp -60.38 -36.98 79.35 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-N 114.613 -1.176 . . . . 0.0 113.133 -178.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.8 pt-20 -62.65 -31.43 72.3 Favored 'General case' 0 C--O 1.202 -1.431 0 C-N-CA 118.528 -1.269 . . . . 0.0 110.165 -177.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.481 HD22 HD23 ' A' ' 43' ' ' LEU . 6.3 t30 -74.23 -47.42 35.35 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-O 121.77 0.795 . . . . 0.0 110.099 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 20.4 mt -63.54 -46.46 85.89 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.704 -177.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.749 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.2 p -71.86 -27.86 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.534 -178.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.9 -47.6 84.41 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.55 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.9 t80 -60.09 -46.26 90.18 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.23 173.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.15 97.83 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.367 -176.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -65.09 -39.36 93.07 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 123.603 0.761 . . . . 0.0 111.629 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.7 pttp -70.96 -38.54 72.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.527 0.68 . . . . 0.0 109.923 -177.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.485 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 42.8 t -73.66 -43.2 54.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.915 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.416 ' HG3' HG23 ' A' ' 19' ' ' VAL . 11.0 tm-20 -59.44 -45.3 91.98 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.88 -41.37 94.14 Favored Glycine 0 C--O 1.221 -0.696 0 O-C-N 123.663 0.602 . . . . 0.0 112.281 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.9 -54.34 48.06 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.104 0.562 . . . . 0.0 111.195 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.482 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -67.24 -34.13 76.81 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.673 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -62.37 -43.37 98.98 Favored 'General case' 0 C--O 1.2 -1.521 0 C-N-CA 123.754 0.822 . . . . 0.0 109.083 176.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -81.6 -15.29 55.17 Favored 'General case' 0 C--N 1.311 -1.076 0 O-C-N 121.414 -0.804 . . . . 0.0 112.035 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.5 t -85.43 -44.37 12.8 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 122.264 -0.273 . . . . 0.0 111.716 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.94 163.63 24.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 -175.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -105.59 -2.42 23.52 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.686 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.2 m -153.5 157.71 40.23 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.483 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -71.8 -34.75 69.62 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 119.885 -0.726 . . . . 0.0 111.113 177.774 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -62.06 -39.28 91.86 Favored 'General case' 0 C--O 1.205 -1.245 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -65.35 -48.48 72.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.535 177.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -44.96 92.35 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 123.434 0.459 . . . . 0.0 110.197 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -60.53 -44.76 95.72 Favored 'General case' 0 C--O 1.208 -1.088 0 O-C-N 123.829 0.706 . . . . 0.0 110.249 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -58.8 -55.78 30.64 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.326 0.65 . . . . 0.0 111.03 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.482 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.5 pp -67.4 -33.72 75.76 Favored 'General case' 0 C--O 1.249 1.061 0 CA-C-O 121.058 0.456 . . . . 0.0 112.096 -175.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.738 HD21 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -74.98 -32.39 61.67 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.471 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.44 -39.54 94.75 Favored 'General case' 0 C--O 1.21 -1.001 0 CA-C-N 115.296 -0.866 . . . . 0.0 109.573 176.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -63.43 -46.22 87.32 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.903 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.492 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.01 -40.75 78.51 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.746 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.524 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -65.13 -44.83 95.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.285 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -56.54 -49.59 74.35 Favored 'General case' 0 C--O 1.264 1.817 0 C-N-CA 124.823 1.249 . . . . 0.0 110.876 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -66.76 -33.25 75.21 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.898 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.492 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -64.29 -39.58 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 176.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.524 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 34.0 mt-30 -63.15 -46.03 89.12 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.294 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.591 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -68.83 -31.04 69.74 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 118.901 -1.12 . . . . 0.0 113.507 177.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.5 tp10 -61.2 -52.33 65.26 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.509 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -61.46 -43.59 98.6 Favored 'General case' 0 C--O 1.243 0.734 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -177.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.499 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 11.4 pt-20 -69.7 -44.03 71.22 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 119.697 -0.801 . . . . 0.0 112.358 -177.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -73.47 -32.91 64.58 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.504 -178.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.591 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -66.49 -40.54 89.33 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.22 179.214 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.591 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 19.9 tpp180 . . . . . 0 N--CA 1.438 -1.029 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.912 -178.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.509 HD21 ' HB3' ' A' ' 79' ' ' LEU . 42.9 tp . . . . . 0 N--CA 1.437 -1.114 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.8 tp -66.43 -41.39 89.28 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 172.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 28.7 m -58.96 -41.93 88.69 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.2 m -66.66 -41.11 88.69 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-O 121.301 0.572 . . . . 0.0 111.154 175.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 15.9 t70 . . . . . 0 N--CA 1.477 0.896 0 C-N-CA 124.26 1.024 . . . . 0.0 110.347 178.246 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 24.4 ptm . . . . . 0 C--O 1.201 -1.477 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.425 ' HA ' HG22 ' B' ' 145' ' ' ILE . 22.0 mm-40 -37.89 -54.9 1.25 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 117.405 2.372 . . . . 0.0 117.405 -175.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 16.2 t -71.26 -30.81 66.75 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 119.749 -0.781 . . . . 0.0 110.317 -177.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 49.1 mm -74.82 -44.5 45.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.708 -179.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.425 HG22 ' HA ' ' B' ' 142' ' ' GLU . 18.5 tt -69.11 -31.32 49.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 CA-C-O 120.754 0.312 . . . . 0.0 110.248 -179.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 4.0 tpp180 -63.4 -61.51 2.3 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 173.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 40.3 t -55.01 -53.76 51.66 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.575 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -81.93 -46.1 14.5 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -172.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 72' ' ' ILE . 10.4 tt . . . . . 0 C--N 1.301 -1.538 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -169.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.432 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 13.4 ptpt . . . . . 0 N--CA 1.423 -1.819 0 CA-C-O 121.81 0.814 . . . . 0.0 113.022 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.45 -14.59 28.18 Favored Glycine 0 C--O 1.238 0.367 0 CA-C-N 113.762 -1.563 . . . . 0.0 115.079 -175.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.534 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 69.4 p-90 -73.69 -3.01 25.65 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 122.242 -0.564 . . . . 0.0 111.992 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -62.91 -24.0 67.63 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 121.153 0.502 . . . . 0.0 110.971 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -79.19 -20.75 47.61 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.572 0.701 . . . . 0.0 109.786 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.534 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 13.4 m-70 -90.29 2.84 55.07 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.649 -1.159 . . . . 0.0 110.116 -174.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.483 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.4 p -132.64 123.86 50.09 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.774 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 m -87.81 154.4 20.57 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.874 -175.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.5 -43.25 75.47 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 172.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -62.08 -32.59 73.15 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.499 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.501 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.24 -52.15 15.07 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 -177.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.541 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.4 ptm180 -63.79 -42.74 97.67 Favored 'General case' 0 N--CA 1.425 -1.698 0 CA-C-N 114.618 -1.174 . . . . 0.0 112.844 -178.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.1 t -65.66 -33.53 76.1 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.242 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -64.24 -44.41 91.91 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.757 HD23 HD21 ' A' ' 68' ' ' LEU . 4.8 mp -64.82 -39.45 93.61 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.235 178.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 15' ' ' ARG . 65.1 t -58.32 -51.04 76.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.512 0.725 . . . . 0.0 110.01 174.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.423 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 16.4 t-80 -51.98 -47.27 64.92 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 124.23 1.012 . . . . 0.0 110.503 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.622 ' HD3' HD22 ' B' ' 149' ' ' LEU . 40.3 mttm -68.71 -41.14 79.52 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.593 178.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.476 ' O ' HG22 ' A' ' 26' ' ' ILE . 31.6 mt -51.32 -50.27 59.73 Favored 'General case' 0 CA--C 1.501 -0.923 0 O-C-N 123.931 0.769 . . . . 0.0 109.743 175.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 43' ' ' LEU . 46.2 t -53.69 -53.78 23.74 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.577 0 O-C-N 124.549 1.155 . . . . 0.0 110.199 175.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.423 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 97.9 mt-30 -51.14 -39.38 56.14 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -177.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.43 ' HB3' HG13 ' A' ' 72' ' ' ILE . . . -81.71 -46.35 14.4 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.504 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.03 -23.8 17.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.881 0.848 . . . . 0.0 109.674 -174.637 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.538 ' CG ' HD22 ' A' ' 43' ' ' LEU . 50.6 m-85 -136.65 87.99 20.01 Favored Pre-proline 0 N--CA 1.408 -2.558 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.014 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -55.56 113.36 1.39 Allowed 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 121.583 1.522 . . . . 0.0 109.426 174.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -77.1 137.23 65.31 Favored Pre-proline 0 N--CA 1.42 -1.971 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.725 -176.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.43 -25.72 15.01 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.937 2.424 . . . . 0.0 111.814 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -151.97 144.41 16.74 Favored Pre-proline 0 CA--C 1.497 -1.087 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -177.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -60.25 -22.96 72.59 Favored 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.115 1.876 . . . . 0.0 113.131 175.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.55 -3.26 57.51 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 121.348 -0.845 . . . . 0.0 111.095 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.15 -9.94 59.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 173.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.46 ' HA ' ' CE ' ' A' ' 40' ' ' MET . 20.2 mt -88.44 6.75 36.09 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.611 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -136.06 12.28 3.34 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-O 121.937 0.875 . . . . 0.0 109.159 173.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.692 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 23.1 t70 -91.83 -179.82 5.42 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 114.416 -1.265 . . . . 0.0 110.614 -170.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.692 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.66 -26.86 62.71 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-O 121.02 0.438 . . . . 0.0 110.526 175.608 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.677 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -66.23 -30.07 70.44 Favored 'General case' 0 C--O 1.247 0.932 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 174.696 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.569 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.98 -40.85 90.51 Favored 'General case' 0 C--O 1.193 -1.884 0 CA-C-O 118.476 -0.773 . . . . 0.0 110.976 -179.004 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.2 pt-20 -61.49 -31.8 71.8 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.507 -174.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.509 HD22 HD23 ' A' ' 43' ' ' LEU . 5.5 t30 -75.68 -43.23 48.38 Favored 'General case' 0 C--O 1.262 1.76 0 CA-C-O 121.479 0.656 . . . . 0.0 110.57 176.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.677 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 17.9 mt -64.14 -47.29 80.52 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.261 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 40' ' ' MET . 27.7 m -69.37 -30.63 46.43 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.05 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.082 178.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.26 -50.42 69.54 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 175.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.565 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.1 t80 -59.68 -48.37 81.95 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.444 174.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.69 -38.39 87.65 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 120.552 -0.459 . . . . 0.0 112.085 -175.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.07 -45.81 76.2 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 123.036 0.535 . . . . 0.0 110.665 177.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -64.03 -38.14 89.98 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.485 0.66 . . . . 0.0 110.139 -177.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.489 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 50.0 t -73.1 -44.07 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.836 179.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -58.3 -45.63 87.62 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 177.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.76 -42.24 97.92 Favored Glycine 0 CA--C 1.503 -0.714 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.153 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.438 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 27.0 t70 -55.06 -54.37 43.93 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 123.026 0.53 . . . . 0.0 111.26 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.645 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -70.39 -30.35 67.23 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -179.611 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -62.32 -48.51 79.52 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 176.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -73.74 -24.24 59.87 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.519 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -75.03 -31.93 61.45 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-O 121.417 0.627 . . . . 0.0 110.037 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.56 167.09 12.83 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 121.683 0.754 . . . . 0.0 112.977 -175.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.418 HD22 ' C ' ' A' ' 59' ' ' ASN . 0.3 OUTLIER -118.5 11.35 12.9 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.97 -179.86 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.3 p -164.76 156.22 15.27 Favored 'General case' 0 N--CA 1.421 -1.917 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.483 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.14 -28.16 63.08 Favored 'General case' 0 C--O 1.202 -1.404 0 C-N-CA 119.447 -0.901 . . . . 0.0 111.065 179.756 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -61.34 -47.79 84.26 Favored 'General case' 0 C--O 1.211 -0.925 0 O-C-N 123.66 0.6 . . . . 0.0 109.581 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 5.1 tp10 -60.93 -48.97 79.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.257 177.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -46.41 81.99 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.031 -175.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -62.66 -41.23 98.95 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 123.542 0.526 . . . . 0.0 109.742 176.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 -60.05 -57.54 12.39 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.131 0.572 . . . . 0.0 112.244 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.645 HD11 ' HB2' ' A' ' 54' ' ' MET . 3.6 pp -66.57 -32.08 73.19 Favored 'General case' 0 C--O 1.252 1.206 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -174.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.757 HD21 HD23 ' A' ' 18' ' ' LEU . 1.0 OUTLIER -75.86 -31.42 59.27 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.44 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.481 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -65.2 -34.39 78.26 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.77 175.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -68.82 -44.36 73.66 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.393 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.1 -39.08 86.65 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.174 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.482 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 7.2 tt -66.54 -44.3 90.25 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.47 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.224 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.452 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 54.4 t80 -55.36 -51.64 66.14 Favored 'General case' 0 C--O 1.255 1.386 0 C-N-CA 124.741 1.217 . . . . 0.0 111.022 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.87 -34.64 78.88 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.676 -178.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.15 -38.53 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.897 178.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.527 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 33.4 mt-30 -66.69 -41.57 87.84 Favored 'General case' 0 CA--C 1.509 -0.611 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.075 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.54 ' HA ' ' HG2' ' A' ' 80' ' ' GLU . 0.6 OUTLIER -71.7 -28.27 63.59 Favored 'General case' 0 N--CA 1.424 -1.741 0 C-N-CA 118.936 -1.106 . . . . 0.0 113.541 176.199 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -66.57 -42.3 87.26 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.594 ' O ' ' HB2' ' A' ' 83' ' ' ARG . 4.6 pp -65.83 -46.09 79.83 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.957 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 16.9 pt-20 -68.93 -35.36 76.71 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 119.246 -0.981 . . . . 0.0 111.904 -177.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.9 pt-20 -68.53 -42.08 78.98 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 120.039 -0.665 . . . . 0.0 111.168 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.613 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -70.02 -33.66 72.28 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.494 0.664 . . . . 0.0 110.761 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.613 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 26.5 ttt180 . . . . . 0 N--CA 1.428 -1.536 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.945 -172.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.52 HD21 ' HB3' ' A' ' 79' ' ' LEU . 26.3 tp . . . . . 0 N--CA 1.437 -1.104 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.598 HD23 ' NZ ' ' A' ' 82' ' ' LYS . 2.9 tm? -67.43 -35.93 80.22 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 172.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 47.0 m -62.7 -37.43 86.44 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 177.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . 0.503 ' HB3' ' HA ' ' A' ' 27' ' ' PHE . 13.3 m -66.58 -49.54 66.05 Favored 'General case' 0 CA--C 1.557 1.219 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.509 173.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.2 t0 . . . . . 0 N--CA 1.487 1.408 0 C-N-CA 124.251 1.021 . . . . 0.0 111.149 179.322 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.512 ' HB3' ' HB ' ' B' ' 145' ' ' ILE . 63.6 mtm . . . . . 0 C--O 1.205 -1.267 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 8.57 -73.63 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 127.651 2.381 . . . . 0.0 117.147 -174.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 7.0 p -70.56 -44.76 66.77 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-O 121.544 0.688 . . . . 0.0 111.618 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 69.7 mt -62.32 -53.63 44.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.228 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.512 ' HB ' ' HB3' ' B' ' 141' ' ' MET . 16.2 tt -64.66 -31.3 53.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.822 -176.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -63.36 -54.44 36.92 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 39.0 t -67.09 -41.75 85.8 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.222 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -79.55 -53.91 6.41 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -174.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.622 HD22 ' HD3' ' A' ' 21' ' ' LYS . 10.2 tt . . . . . 0 C--N 1.303 -1.415 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -175.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt . . . . . 0 N--CA 1.424 -1.748 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.46 -14.35 8.99 Favored Glycine 0 N--CA 1.475 1.282 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 -170.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.2 p-90 -73.02 -11.69 60.65 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 117.535 0.667 . . . . 0.0 111.835 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.45 -18.39 50.98 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 121.248 0.547 . . . . 0.0 111.691 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -75.73 -21.73 57.23 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.301 0.572 . . . . 0.0 110.448 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -101.92 14.29 32.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.353 0.597 . . . . 0.0 111.631 -174.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.429 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 4.1 p -135.11 110.63 12.54 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.229 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.12 165.72 12.1 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.151 -0.931 . . . . 0.0 113.337 -176.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -36.13 76.21 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.669 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -71.8 -33.21 68.37 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.03 -0.668 . . . . 0.0 111.888 -176.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.547 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -66.81 -50.52 62.37 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.51 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.3 ptm180 -67.92 -42.91 80.35 Favored 'General case' 0 N--CA 1.413 -2.279 0 CA-C-N 114.291 -1.322 . . . . 0.0 112.433 -177.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.1 t -63.96 -26.99 68.83 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.197 0.523 . . . . 0.0 110.277 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 8.5 t60 -65.62 -52.63 50.48 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 175.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.772 HD23 HD21 ' A' ' 68' ' ' LEU . 4.4 mp -61.39 -42.66 99.08 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.356 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 15' ' ' ARG . 51.5 t -55.92 -50.32 69.74 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 C-N-CA 124.442 1.097 . . . . 0.0 110.487 175.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -55.33 -42.63 74.06 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 123.833 0.853 . . . . 0.0 110.477 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 46.6 mttm -69.58 -36.54 76.35 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.317 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 19' ' ' VAL . 83.5 mt -57.01 -42.1 79.7 Favored 'General case' 0 CA--C 1.518 -0.268 0 O-C-N 123.286 0.366 . . . . 0.0 110.022 175.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.487 HG11 ' HE1' ' A' ' 40' ' ' MET . 55.7 t -56.88 -52.84 50.12 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.148 0 O-C-N 124.22 0.95 . . . . 0.0 110.533 171.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -54.65 -33.54 60.8 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.453 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.0 -43.95 18.84 Favored 'General case' 0 C--O 1.206 -1.195 0 CA-C-O 121.16 0.505 . . . . 0.0 111.856 177.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.451 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.6 tt -73.72 -31.42 31.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 O-C-N 120.952 -1.092 . . . . 0.0 110.885 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.404 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 17.9 m-85 -132.07 95.44 21.86 Favored Pre-proline 0 C--N 1.264 -3.144 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.176 -176.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 18.7 Cg_endo -63.89 94.14 0.19 Allowed 'Trans proline' 0 C--N 1.358 1.034 0 C-N-CA 122.219 1.946 . . . . 0.0 110.556 177.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.411 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 14.6 t -62.94 132.56 95.01 Favored Pre-proline 0 N--CA 1.426 -1.649 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.383 -175.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -67.51 -33.14 29.88 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.7 2.267 . . . . 0.0 111.791 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -150.9 147.65 21.31 Favored Pre-proline 0 C--N 1.306 -1.289 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 -177.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -56.29 -17.87 22.3 Favored 'Trans proline' 0 CA--C 1.553 1.425 0 C-N-CA 122.507 2.138 . . . . 0.0 113.596 174.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.33 -6.02 59.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.696 -0.627 . . . . 0.0 112.193 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.411 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -81.84 -11.35 58.99 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 122.138 0.971 . . . . 0.0 108.8 175.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.463 ' O ' ' HG2' ' A' ' 40' ' ' MET . 33.8 mt -84.91 4.51 33.11 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.233 -1.348 . . . . 0.0 110.472 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -133.22 17.36 4.08 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-O 121.863 0.84 . . . . 0.0 109.856 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.584 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 37.2 t70 -92.02 177.11 6.27 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.827 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.81 -26.84 63.48 Favored 'General case' 0 C--N 1.307 -1.248 0 O-C-N 122.28 -0.262 . . . . 0.0 110.409 176.478 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.581 ' O ' HD13 ' A' ' 43' ' ' LEU . 39.8 ttm180 -60.08 -35.81 76.0 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.719 0.771 . . . . 0.0 109.558 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.61 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.8 tpp -57.83 -32.27 67.44 Favored 'General case' 0 C--O 1.2 -1.509 0 CA-C-N 114.603 -1.18 . . . . 0.0 112.228 178.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 13.5 pt-20 -64.28 -32.37 73.93 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 118.551 -1.26 . . . . 0.0 110.299 -178.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.475 HD22 HD12 ' A' ' 43' ' ' LEU . 1.7 t30 -72.6 -45.28 59.84 Favored 'General case' 0 C--O 1.253 1.27 0 CA-C-O 122.277 1.037 . . . . 0.0 109.139 176.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.581 HD13 ' O ' ' A' ' 39' ' ' ARG . 3.0 mp -55.7 -56.33 21.76 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 113.551 -1.659 . . . . 0.0 110.165 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.61 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 2.7 p -70.28 -27.55 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.858 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.176 -176.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.6 -49.36 76.67 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 176.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.526 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.1 t80 -62.21 -45.55 92.85 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.083 175.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.22 -45.99 83.34 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.915 -177.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -63.88 -43.84 94.84 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 124.055 0.942 . . . . 0.0 112.857 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 59.1 pttt -64.09 -41.05 97.44 Favored 'General case' 0 C--O 1.251 1.163 0 CA-C-O 121.582 0.706 . . . . 0.0 110.175 -177.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.479 HG21 ' CE2' ' A' ' 46' ' ' TYR . 55.9 t -73.1 -45.04 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.163 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.415 ' HG3' HG23 ' A' ' 19' ' ' VAL . 14.9 tm-20 -58.06 -45.25 87.37 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 177.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.25 -43.15 93.7 Favored Glycine 0 N--CA 1.438 -1.203 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.111 178.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -58.53 -54.12 50.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.661 0.267 . . . . 0.0 111.495 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.432 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -65.77 -31.43 72.4 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 179.665 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -65.05 -38.74 91.83 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -82.09 -23.25 35.85 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 121.747 -0.596 . . . . 0.0 112.063 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -80.22 -40.95 26.1 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 123.047 0.539 . . . . 0.0 111.473 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.17 161.09 29.1 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -106.12 7.4 31.68 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.829 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.5 p -159.11 157.9 31.88 Favored 'General case' 0 CA--C 1.477 -1.849 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.429 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -72.48 -24.43 61.18 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.066 -1.053 . . . . 0.0 109.614 178.184 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -67.57 -47.48 69.66 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 115.088 -0.96 . . . . 0.0 108.499 177.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -60.36 -46.59 89.39 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.496 175.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -46.4 85.87 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 123.319 0.387 . . . . 0.0 110.631 -177.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.402 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 2.9 t80 -62.0 -44.67 96.24 Favored 'General case' 0 C--O 1.216 -0.707 0 O-C-N 123.643 0.59 . . . . 0.0 110.679 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -67.7 -43.13 80.85 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.432 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.3 pp -71.69 -35.18 70.17 Favored 'General case' 0 C--O 1.25 1.079 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.123 -177.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.772 HD21 HD23 ' A' ' 18' ' ' LEU . 1.3 pp -72.26 -33.68 67.67 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.551 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.51 -39.63 94.93 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.03 176.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -62.15 -49.47 75.73 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.433 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -34.55 72.51 Favored 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.042 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.56 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 4.9 tt -70.88 -45.85 71.13 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.563 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -55.15 -50.75 68.48 Favored 'General case' 0 C--O 1.282 2.798 0 C-N-CA 124.665 1.186 . . . . 0.0 110.887 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -62.98 -39.5 94.91 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.629 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.453 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.3 mp -62.44 -39.92 86.14 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.981 0 O-C-N 123.356 0.41 . . . . 0.0 111.861 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.631 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 22.1 mm-40 -57.75 -49.67 75.81 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 121.87 0.843 . . . . 0.0 109.637 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.496 ' H ' ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -70.45 -38.21 74.44 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.661 0.985 . . . . 0.0 113.661 178.076 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.33 -45.53 91.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 3.7 pp -64.25 -42.82 96.33 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.489 -177.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.462 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 4.7 mm-40 -68.9 -41.44 78.25 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -70.47 -35.03 73.06 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 119.464 -0.894 . . . . 0.0 111.438 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.53 -29.87 62.74 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.549 0.69 . . . . 0.0 109.788 178.009 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 4.9 tmm_? . . . . . 0 C--N 1.321 -0.632 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.01 -177.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.526 HD21 ' HB3' ' A' ' 79' ' ' LEU . 31.8 tp . . . . . 0 C--O 1.199 -1.562 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.19 -40.03 82.32 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 174.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 43.6 m -63.81 -39.53 94.46 Favored 'General case' 0 CA--C 1.552 1.021 0 CA-C-O 121.353 0.597 . . . . 0.0 109.402 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.1 t -68.44 -42.49 78.76 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.398 177.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 16.9 t70 . . . . . 0 N--CA 1.476 0.844 0 C-N-CA 125.898 1.679 . . . . 0.0 111.278 179.328 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.514 ' HB3' ' HB ' ' B' ' 145' ' ' ILE . 69.3 mtp . . . . . 0 N--CA 1.434 -1.26 0 CA-C-O 119.457 -0.306 . . . . 0.0 110.423 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 25.64 -84.13 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 127.853 2.461 . . . . 0.0 115.502 176.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.1 p -72.86 -47.1 48.96 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 114.55 -1.204 . . . . 0.0 111.216 -175.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 65.3 mt -63.79 -41.91 94.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.767 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.514 ' HB ' ' HB3' ' B' ' 141' ' ' MET . 9.5 tp -66.19 -41.32 89.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.097 0 C-N-CA 119.617 -0.833 . . . . 0.0 110.693 -178.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -66.17 -57.08 8.4 Favored 'General case' 0 N--CA 1.436 -1.128 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.133 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 43.4 t -55.2 -53.96 49.41 Favored 'General case' 0 C--O 1.249 1.049 0 C-N-CA 123.757 0.823 . . . . 0.0 113.133 -176.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.444 ' O ' ' HB1' ' A' ' 69' ' ' ALA . 5.5 mm-40 -81.84 -42.25 19.89 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -172.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.495 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 1.5 tm? . . . . . 0 N--CA 1.454 -0.241 0 C-N-CA 120.469 -0.493 . . . . 0.0 110.358 -173.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.503 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.6 ptpt . . . . . 0 N--CA 1.427 -1.617 0 CA-C-O 121.643 0.735 . . . . 0.0 111.647 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.414 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -74.02 -0.68 57.17 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 114.589 -1.187 . . . . 0.0 113.702 -175.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.503 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 52.2 p-90 -72.67 -7.74 51.86 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 117.57 0.685 . . . . 0.0 111.584 177.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.4 p80 -65.99 -9.61 31.84 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 9.7 pt-20 -88.13 -8.64 55.12 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.272 0.558 . . . . 0.0 110.027 174.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -94.98 9.89 37.67 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.533 0.682 . . . . 0.0 109.867 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.421 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.6 p -141.79 155.17 19.8 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.2 m -123.69 160.59 26.88 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.62 -36.1 71.34 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 120.903 0.382 . . . . 0.0 110.226 175.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 4.0 m-20 -63.68 -33.69 76.19 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.521 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.17 -51.13 19.01 Favored 'General case' 0 CA--C 1.498 -1.055 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 -177.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.517 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -64.81 -44.18 90.75 Favored 'General case' 0 N--CA 1.423 -1.802 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.976 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.8 t -66.29 -29.17 69.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.438 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 18.2 t60 -65.18 -44.69 87.64 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.727 HD23 HD21 ' A' ' 68' ' ' LEU . 3.7 mp -66.6 -39.64 88.48 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.338 177.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 15' ' ' ARG . 55.0 t -57.45 -51.9 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.842 0.857 . . . . 0.0 110.3 175.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -55.98 -45.78 78.86 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.314 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -65.84 -40.22 91.55 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.245 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 19' ' ' VAL . 28.7 mt -51.26 -50.29 59.52 Favored 'General case' 0 CA--C 1.498 -1.048 0 O-C-N 123.676 0.61 . . . . 0.0 109.543 174.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.424 HG13 ' HB3' ' A' ' 43' ' ' LEU . 41.9 t -53.92 -51.69 42.92 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.497 0 O-C-N 124.468 1.105 . . . . 0.0 110.528 175.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -55.77 -35.41 66.21 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -176.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.486 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -81.44 -45.58 15.84 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 177.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.503 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.72 -25.49 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 122.044 0.926 . . . . 0.0 110.565 -174.682 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.587 ' CG ' HD22 ' A' ' 43' ' ' LEU . 57.6 m-85 -131.44 98.07 18.77 Favored Pre-proline 0 C--N 1.278 -2.514 0 CA-C-N 115.289 -0.869 . . . . 0.0 108.732 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -49.51 133.63 31.83 Favored 'Trans proline' 0 CA--C 1.48 -2.183 0 C-N-CA 122.394 2.063 . . . . 0.0 111.209 177.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.1 m -91.28 116.8 67.17 Favored Pre-proline 1 N--CA 1.369 -4.505 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.374 -174.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -79.92 -30.42 2.27 Favored 'Trans proline' 0 C--N 1.323 -0.78 0 C-N-CA 122.088 1.858 . . . . 0.0 111.255 176.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -147.84 147.43 27.03 Favored Pre-proline 0 CA--C 1.488 -1.431 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -69.2 -12.02 32.97 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 121.231 1.287 . . . . 0.0 110.283 172.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.32 -13.71 45.75 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.089 175.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.717 ' HA ' ' OD2' ' A' ' 37' ' ' ASP . . . -72.07 -15.17 62.01 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 122.18 0.991 . . . . 0.0 109.478 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.9 mt -85.36 7.34 22.79 Favored 'General case' 0 N--CA 1.426 -1.629 0 CA-C-N 113.592 -1.64 . . . . 0.0 109.403 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -132.89 0.44 3.5 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 118.984 -1.087 . . . . 0.0 109.914 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.717 ' OD2' ' HA ' ' A' ' 34' ' ' ALA . 48.5 m-20 -72.88 176.86 5.28 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.157 -175.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.645 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -65.35 -21.81 66.74 Favored 'General case' 0 C--O 1.203 -1.342 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 170.637 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.636 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 41.0 ttp180 -65.04 -29.52 70.43 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.19 175.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.589 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.02 -39.57 82.31 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-O 118.763 -0.636 . . . . 0.0 110.209 -179.503 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.8 pt-20 -62.81 -28.37 69.96 Favored 'General case' 0 C--O 1.205 -1.257 0 O-C-N 123.238 0.336 . . . . 0.0 110.946 -176.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.637 HD22 HD23 ' A' ' 43' ' ' LEU . 4.6 t30 -76.17 -46.18 29.78 Favored 'General case' 0 C--O 1.265 1.911 0 CA-C-O 121.696 0.76 . . . . 0.0 110.008 177.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.637 HD23 HD22 ' A' ' 42' ' ' ASN . 18.3 mt -63.81 -49.57 72.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.204 -178.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 40' ' ' MET . 34.0 m -68.52 -33.17 58.57 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.294 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.383 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.21 -46.97 75.92 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 118.325 0.511 . . . . 0.0 109.991 175.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.543 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 6.6 t80 -63.1 -48.64 77.7 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.645 174.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.35 -43.52 88.35 Favored 'General case' 0 C--O 1.201 -1.474 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.356 -176.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -66.19 -40.77 90.65 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 124.117 0.967 . . . . 0.0 111.827 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 53.2 pttt -66.71 -40.71 88.55 Favored 'General case' 0 C--O 1.251 1.151 0 CA-C-O 121.497 0.665 . . . . 0.0 109.945 -178.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.412 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 79.3 t -71.63 -49.23 47.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.605 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.3 tm-20 -57.93 -47.67 82.18 Favored 'General case' 0 CA--C 1.51 -0.594 0 C-N-CA 123.836 0.854 . . . . 0.0 109.17 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.77 -38.72 92.61 Favored Glycine 0 N--CA 1.428 -1.859 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.445 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -64.11 -51.78 62.34 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 111.543 0.201 . . . . 0.0 111.543 178.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.437 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -64.28 -32.38 73.96 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 178.025 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -64.78 -41.62 95.7 Favored 'General case' 0 C--O 1.201 -1.476 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -80.73 -16.78 53.0 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.622 -0.674 . . . . 0.0 112.097 177.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.3 t -82.78 -52.99 6.25 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 122.536 0.334 . . . . 0.0 111.433 -178.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.17 161.66 13.18 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -175.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -104.73 6.28 34.04 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.316 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.0 p -162.42 156.22 20.93 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 174.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -67.76 -31.15 70.84 Favored 'General case' 0 C--O 1.201 -1.499 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.458 -178.787 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -65.21 -47.22 77.64 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.303 177.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -58.26 -45.16 88.34 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 111.417 0.155 . . . . 0.0 111.417 175.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -44.14 92.21 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.513 -178.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -62.46 -45.59 92.35 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.295 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.529 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 34.0 m170 -61.1 -53.97 50.47 Favored 'General case' 0 C--O 1.215 -0.741 0 O-C-N 123.274 0.359 . . . . 0.0 111.634 -178.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.437 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.4 pp -64.33 -36.73 85.09 Favored 'General case' 0 C--O 1.256 1.417 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -175.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.727 HD21 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -74.67 -33.86 62.57 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.523 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.46 -32.76 74.3 Favored 'General case' 0 C--O 1.205 -1.275 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.343 175.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 22.1 mt-10 -72.4 -41.37 66.36 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.276 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -65.82 -39.03 90.45 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.403 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.523 HG22 ' HA ' ' A' ' 69' ' ' ALA . 8.7 tt -68.24 -42.99 85.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.297 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.491 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 39.1 t80 -58.19 -52.48 65.38 Favored 'General case' 0 C--O 1.259 1.578 0 C-N-CA 124.427 1.091 . . . . 0.0 111.348 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -64.4 -33.34 75.63 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.464 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -68.92 -37.68 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.867 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.167 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.509 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 11.5 mt-30 -66.6 -41.48 88.38 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.629 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.511 ' HE2' ' HB3' ' A' ' 77' ' ' LYS . 10.6 ptpt -75.23 -27.09 59.37 Favored 'General case' 0 N--CA 1.424 -1.763 0 C-N-CA 118.982 -1.087 . . . . 0.0 112.759 176.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.518 ' OE2' ' HG2' ' A' ' 82' ' ' LYS . 5.5 tm-20 -62.56 -48.89 77.51 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 175.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.597 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -63.7 -39.67 94.89 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.836 178.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -55.56 -53.6 54.4 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 123.466 0.479 . . . . 0.0 111.289 176.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -68.92 -47.03 66.78 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 120.15 -0.62 . . . . 0.0 112.418 -177.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.518 ' HG2' ' OE2' ' A' ' 78' ' ' GLU 0.254 0.0 OUTLIER -74.09 -38.73 63.79 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -176.337 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 7.6 mmm180 . . . . . 0 C--N 1.307 -1.279 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.597 HD21 ' HB3' ' A' ' 79' ' ' LEU . 52.9 tp . . . . . 0 C--O 1.201 -1.454 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.2 tp -67.83 -36.71 80.83 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.192 177.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 88.0 m -64.92 -46.73 80.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.097 176.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.5 m -64.12 -38.08 89.76 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.616 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 C--N 1.317 -0.805 0 C-N-CA 123.746 0.818 . . . . 0.0 111.851 177.332 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 24.9 ptt? . . . . . 0 C--O 1.208 -1.103 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -28.51 -61.14 0.12 Allowed 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 126.543 1.937 . . . . 0.0 116.162 -172.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 18.5 m -68.04 -35.72 78.72 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.105 0.478 . . . . 0.0 111.48 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 62.1 mt -72.16 -45.79 60.9 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.891 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.601 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 18.0 tt -68.26 -31.57 52.09 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.4 -178.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 49.3 ttp180 -64.86 -54.75 26.07 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 33.1 t -59.24 -50.15 75.11 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.787 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -81.27 -42.69 20.28 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -175.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.601 ' HB3' ' O ' ' B' ' 145' ' ' ILE . 4.0 tt . . . . . 0 C--N 1.31 -1.119 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -172.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 14.6 ptpt . . . . . 0 N--CA 1.43 -1.461 0 CA-C-O 121.34 0.59 . . . . 0.0 111.669 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.2 -12.26 16.02 Favored Glycine 0 N--CA 1.465 0.612 0 N-CA-C 116.075 1.19 . . . . 0.0 116.075 -173.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.471 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 57.3 p-90 -64.06 -17.07 63.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.542 0.671 . . . . 0.0 111.035 178.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.471 ' HA ' HG12 ' A' ' 10' ' ' VAL . 1.4 p-80 -63.33 -10.39 16.2 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.7 -30.45 59.32 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.349 0.595 . . . . 0.0 109.88 175.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -93.11 20.41 6.87 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.524 -174.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.471 HG12 ' HA ' ' A' ' 7' ' ' HIS . 7.7 p -132.98 110.19 15.1 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -75.89 153.07 36.98 Favored 'General case' 0 C--N 1.294 -1.839 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.916 -173.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -38.84 86.1 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 174.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.513 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 3.5 m-20 -56.91 -39.14 73.89 Favored 'General case' 0 C--O 1.214 -0.763 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.629 174.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.584 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -72.42 -52.35 16.33 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -173.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.6 ptm180 -66.15 -43.37 87.21 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-N 114.944 -1.025 . . . . 0.0 113.293 -176.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.2 t -67.11 -28.66 68.34 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 14.9 t60 -65.71 -44.12 87.04 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 176.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.698 HD23 HD21 ' A' ' 68' ' ' LEU . 4.1 mp -65.26 -41.41 94.27 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.888 176.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 15' ' ' ARG . 67.6 t -57.21 -52.42 56.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.665 0.786 . . . . 0.0 110.169 176.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.435 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 20.5 t-80 -54.93 -43.79 73.65 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.494 177.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.476 ' HD3' ' HG ' ' B' ' 149' ' ' LEU . 36.2 mttp -66.1 -37.95 87.02 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.375 177.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 19' ' ' VAL . 74.2 mt -55.67 -43.08 75.99 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 175.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.482 ' HA ' HG22 ' A' ' 26' ' ' ILE . 53.6 t -57.25 -52.65 53.84 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.628 0 O-C-N 124.155 0.91 . . . . 0.0 110.411 173.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -59.05 -29.15 67.09 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.71 -45.31 15.88 Favored 'General case' 0 C--O 1.207 -1.133 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.769 174.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.482 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.7 tt -69.78 -33.75 57.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-O 122.07 0.938 . . . . 0.0 110.233 -177.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -126.39 92.26 45.77 Favored Pre-proline 0 N--CA 1.4 -2.971 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -57.7 102.17 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 121.849 1.7 . . . . 0.0 107.955 171.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 t -73.92 128.27 86.88 Favored Pre-proline 0 N--CA 1.408 -2.568 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.637 -172.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -72.65 -28.83 13.66 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.417 2.078 . . . . 0.0 111.438 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -151.01 147.12 20.04 Favored Pre-proline 0 CA--C 1.498 -1.033 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -177.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.41 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 9.9 Cg_endo -56.93 -19.66 33.03 Favored 'Trans proline' 0 CA--C 1.549 1.274 0 C-N-CA 122.359 2.039 . . . . 0.0 114.171 175.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.38 -19.97 59.24 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 121.406 -0.809 . . . . 0.0 112.005 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.68 -7.56 50.99 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.383 0.611 . . . . 0.0 110.421 178.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.462 ' O ' ' HG2' ' A' ' 40' ' ' MET . 23.6 mt -93.48 0.31 56.68 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.689 -178.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -133.72 19.77 3.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.243 0.544 . . . . 0.0 111.979 -177.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.548 ' O ' ' HB3' ' A' ' 40' ' ' MET . 38.0 t70 -92.12 176.69 6.4 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.734 ' HD2' ' N ' ' A' ' 39' ' ' ARG . 5.4 ppt_? -61.54 -26.1 67.72 Favored 'General case' 0 C--N 1.282 -2.358 0 CA-C-O 121.922 0.868 . . . . 0.0 108.934 172.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.734 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 40.6 ttm180 -63.52 -29.41 70.68 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-O 122.145 0.974 . . . . 0.0 109.109 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.726 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.7 tpp -65.13 -34.64 78.89 Favored 'General case' 0 C--O 1.192 -1.95 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.312 -178.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.631 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.1 pt-20 -63.64 -32.89 74.51 Favored 'General case' 0 C--O 1.189 -2.081 0 C-N-CA 119.396 -0.922 . . . . 0.0 109.445 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -68.99 -49.85 54.21 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 121.589 0.709 . . . . 0.0 110.045 176.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 67.2 mt -63.7 -48.07 78.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.6 -176.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.726 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.4 p -73.42 -27.88 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.885 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.209 -178.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.56 93.94 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 177.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.539 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.1 t80 -60.73 -46.36 90.74 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.942 174.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.23 -40.17 93.01 Favored 'General case' 0 C--O 1.202 -1.443 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.956 -177.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -68.38 -43.72 76.73 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 123.312 0.645 . . . . 0.0 111.306 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.3 pttp -65.74 -38.18 88.42 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 121.118 0.485 . . . . 0.0 109.918 -177.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 41.3 t -70.76 -49.66 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.268 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.401 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -56.04 -44.67 79.0 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.49 -37.97 95.6 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.62 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -59.42 -54.25 48.81 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.445 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -67.67 -34.22 76.5 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.93 -49.85 75.79 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -77.33 -17.68 58.08 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 28.3 t -87.42 -30.85 20.4 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 120.825 0.345 . . . . 0.0 110.929 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.29 159.51 23.13 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 121.246 0.546 . . . . 0.0 111.633 -177.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -108.59 8.48 27.15 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-O 121.717 0.77 . . . . 0.0 110.4 -177.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 83.1 p -160.71 160.71 31.78 Favored 'General case' 0 N--CA 1.417 -2.101 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 173.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.426 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -72.3 -26.76 62.08 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.047 176.677 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -65.48 -47.82 74.77 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -62.83 -46.22 88.94 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.163 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.404 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.64 -48.09 76.09 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.845 -176.419 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -61.38 -45.36 94.67 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 123.796 0.685 . . . . 0.0 110.304 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.543 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 10.7 t60 -67.95 -49.86 59.3 Favored 'General case' 0 C--O 1.203 -1.372 0 CA-C-O 119.23 -0.414 . . . . 0.0 111.752 -176.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.445 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.1 pp -64.55 -35.37 80.76 Favored 'General case' 0 C--O 1.271 2.219 0 CA-C-N 118.517 0.599 . . . . 0.0 111.662 -177.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.698 HD21 HD23 ' A' ' 18' ' ' LEU . 1.3 pp -70.1 -38.55 75.67 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.548 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.75 -35.74 82.06 Favored 'General case' 0 C--O 1.2 -1.508 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.561 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 16.0 mt-10 -67.76 -43.78 79.04 Favored 'General case' 0 C--N 1.312 -1.039 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.684 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -38.93 74.76 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 118.663 -1.215 . . . . 0.0 111.732 -179.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.548 HG22 ' HA ' ' A' ' 69' ' ' ALA . 9.6 tt -65.62 -40.41 87.92 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 C-N-CA 120.564 -0.455 . . . . 0.0 110.112 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.493 ' CZ ' ' HE3' ' A' ' 77' ' ' LYS . 36.6 t80 -57.31 -54.5 46.15 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 124.682 1.193 . . . . 0.0 111.121 179.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.473 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.5 ptpt -66.44 -32.34 73.64 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.083 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.78 -36.92 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.809 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.154 177.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.566 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 19.6 mt-30 -67.44 -47.75 69.26 Favored 'General case' 0 CA--C 1.498 -1.056 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.635 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.505 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -69.45 -28.12 65.83 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.404 -0.919 . . . . 0.0 112.627 177.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.6 tp10 -65.16 -47.85 75.59 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -65.41 -36.07 82.82 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.533 -178.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.98 -47.29 78.08 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.351 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.37 -33.37 65.01 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 119.49 -0.884 . . . . 0.0 111.773 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.553 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -64.58 -36.17 83.37 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.794 178.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.417 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 16.2 tpp180 . . . . . 0 N--CA 1.442 -0.855 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.227 178.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.558 HD21 ' HB3' ' A' ' 79' ' ' LEU . 62.4 tp . . . . . 0 C--O 1.203 -1.389 0 CA-C-O 120.438 0.161 . . . . 0.0 110.618 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 60.8 tp -63.57 -38.82 92.57 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 26.4 m -65.19 -40.15 93.84 Favored 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.983 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.3 t -77.53 -25.58 50.34 Favored 'General case' 0 CA--C 1.561 1.389 0 CA-C-O 121.28 0.562 . . . . 0.0 110.204 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 12.3 t70 . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 121.951 0.882 . . . . 0.0 109.163 176.851 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 C--O 1.198 -1.632 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -22.02 -65.42 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 126.876 2.071 . . . . 0.0 116.218 -174.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.4 p -69.84 -43.92 70.97 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.256 0.551 . . . . 0.0 112.01 -176.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 45.8 mm -69.57 -40.54 79.7 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.465 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 13.2 tt -67.42 -36.78 77.47 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.863 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -55.03 -51.64 65.65 Favored 'General case' 0 C--O 1.25 1.11 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.3 m -61.48 -52.36 64.83 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-N 114.509 -1.223 . . . . 0.0 112.567 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -68.52 -47.83 65.94 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.48 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 2.5 tm? . . . . . 0 C--N 1.306 -1.286 0 CA-C-N 114.953 -1.021 . . . . 0.0 112.756 -168.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.624 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.3 ptpt . . . . . 0 N--CA 1.411 -2.38 0 CA-C-O 121.678 0.752 . . . . 0.0 112.048 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.15 -9.65 84.1 Favored Glycine 0 C--O 1.24 0.517 0 CA-C-N 115.076 -0.965 . . . . 0.0 113.273 -175.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.624 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 65.0 p-90 -68.73 -7.59 35.07 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -59.83 -26.17 65.57 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 120.977 0.418 . . . . 0.0 111.703 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -86.81 0.33 55.04 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.547 0.689 . . . . 0.0 110.677 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.404 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 52.0 m-70 -104.95 3.01 30.28 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.953 -178.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.773 HG22 ' HB3' ' A' ' 61' ' ' ARG . 1.5 t -119.28 128.51 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.681 0 N-CA-C 103.968 -2.604 . . . . 0.0 103.968 176.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.478 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -77.66 151.46 34.26 Favored 'General case' 0 C--N 1.275 -2.665 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -36.15 79.35 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 174.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 32.8 t70 -72.66 -27.83 62.35 Favored 'General case' 0 C--O 1.199 -1.581 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.619 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.449 ' H ' ' HB ' ' A' ' 11' ' ' THR . 3.2 tm? -70.03 -52.95 19.92 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -177.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 1.1 ptm180 -57.89 -48.67 79.16 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 175.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.4 m -67.89 -21.19 65.16 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.192 0.52 . . . . 0.0 111.816 -177.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.446 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 15.9 t60 -69.63 -47.24 64.11 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 175.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.648 HD23 HD21 ' A' ' 68' ' ' LEU . 1.2 mp -64.83 -40.52 95.31 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.768 177.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' ARG . 78.8 t -56.69 -50.38 74.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.68 0.792 . . . . 0.0 109.939 174.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 27.0 t-80 -54.86 -44.15 73.74 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.861 0.864 . . . . 0.0 109.907 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.4 ' HZ3' ' CD1' ' B' ' 145' ' ' ILE . 76.7 mttt -69.48 -36.63 76.72 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.924 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' HG22 ' A' ' 26' ' ' ILE . 63.7 mt -56.38 -45.28 80.64 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 175.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.428 ' HA ' HG22 ' A' ' 26' ' ' ILE . 42.1 t -54.88 -55.56 15.26 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.41 0 O-C-N 124.211 0.944 . . . . 0.0 109.907 172.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -56.63 -30.1 62.93 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -176.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.606 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.32 -45.14 16.62 Favored 'General case' 0 C--O 1.208 -1.081 0 O-C-N 122.18 -0.325 . . . . 0.0 111.717 175.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.428 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.8 tt -70.82 -34.92 58.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 122.051 0.929 . . . . 0.0 110.304 -179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.467 ' CD2' HD22 ' A' ' 43' ' ' LEU . 11.0 m-85 -136.99 88.01 18.35 Favored Pre-proline 0 C--N 1.267 -3.003 0 C-N-CA 124.357 1.063 . . . . 0.0 109.751 -177.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -44.76 133.03 10.47 Favored 'Trans proline' 0 CA--C 1.487 -1.864 0 C-N-CA 122.696 2.264 . . . . 0.0 112.431 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 m -90.27 117.92 68.41 Favored Pre-proline 1 N--CA 1.364 -4.737 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.746 -173.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -76.29 -32.38 4.04 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.702 2.268 . . . . 0.0 111.745 178.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -153.59 144.17 15.83 Favored Pre-proline 0 CA--C 1.489 -1.372 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 -177.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.449 ' HA ' HD12 ' A' ' 35' ' ' LEU . 9.4 Cg_endo -56.02 -23.25 42.71 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.68 2.253 . . . . 0.0 113.817 176.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.26 -14.18 60.88 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 121.377 -0.827 . . . . 0.0 111.719 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 40' ' ' MET . . . -72.29 -15.55 61.9 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.697 0.761 . . . . 0.0 109.487 176.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.85 ' HA ' ' HE3' ' A' ' 40' ' ' MET . 10.4 mt -88.32 -0.87 57.63 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.043 -176.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.39 16.82 4.04 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.648 0.737 . . . . 0.0 109.29 176.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.584 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 17.0 t70 -86.36 173.55 9.62 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.109 -176.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.67 -25.68 62.21 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.025 0.44 . . . . 0.0 110.651 174.262 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.588 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 6.4 tpt180 -62.84 -38.09 89.4 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 175.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.85 ' HE3' ' HA ' ' A' ' 35' ' ' LEU . 9.3 tpp -56.16 -37.18 69.19 Favored 'General case' 0 C--O 1.192 -1.932 0 CA-C-N 113.574 -1.648 . . . . 0.0 112.691 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -61.79 -32.73 73.04 Favored 'General case' 0 C--O 1.212 -0.887 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.652 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.476 HD22 HD23 ' A' ' 43' ' ' LEU . 5.4 t30 -77.21 -43.5 33.43 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-O 121.406 0.622 . . . . 0.0 110.0 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 20.5 mt -63.72 -45.71 88.7 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.644 -178.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.839 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.0 p -73.34 -28.58 25.84 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.368 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.13 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.24 -44.23 95.43 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 176.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.531 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.5 t80 -62.51 -45.8 91.33 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.888 173.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.72 91.55 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.943 -177.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -68.25 -41.05 81.71 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 123.608 0.763 . . . . 0.0 112.375 178.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.531 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 58.3 pttt -65.84 -40.3 91.6 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 55.5 t -71.06 -48.33 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.884 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -58.25 -45.72 87.28 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.85 -42.42 96.6 Favored Glycine 0 N--CA 1.433 -1.522 0 O-C-N 123.928 0.768 . . . . 0.0 112.744 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -58.18 -54.7 44.03 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.489 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.6 OUTLIER -67.0 -33.9 76.56 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.502 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -63.62 -45.17 91.52 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -79.05 -16.59 56.59 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 121.888 -0.507 . . . . 0.0 111.727 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.489 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 29.9 m -87.1 -27.81 22.89 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.63 167.39 15.38 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.52 0.676 . . . . 0.0 112.576 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -115.31 8.63 15.47 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.532 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.4 p -166.66 150.27 7.05 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 175.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.773 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -60.82 -34.15 74.1 Favored 'General case' 0 C--O 1.199 -1.598 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.3 175.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.78 -47.91 83.79 Favored 'General case' 0 C--O 1.219 -0.542 0 O-C-N 123.857 0.723 . . . . 0.0 109.571 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -62.96 -47.34 83.61 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.715 177.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.407 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.57 -46.39 82.94 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.875 -176.768 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -60.92 -44.87 96.59 Favored 'General case' 0 C--O 1.208 -1.13 0 O-C-N 123.84 0.713 . . . . 0.0 109.752 177.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.426 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 53.6 t-80 -58.43 -57.21 13.95 Favored 'General case' 0 C--N 1.323 -0.543 0 O-C-N 123.606 0.566 . . . . 0.0 111.815 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.473 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.7 pp -65.41 -37.11 85.97 Favored 'General case' 0 C--O 1.27 2.156 0 CA-C-O 121.317 0.579 . . . . 0.0 112.167 -175.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.648 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -70.7 -36.89 73.48 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 -179.174 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.52 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.72 -38.39 90.28 Favored 'General case' 0 C--O 1.209 -1.077 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.232 178.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 53.5 mm-40 -61.15 -51.23 69.93 Favored 'General case' 0 C--O 1.262 1.735 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.701 179.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -39.38 81.11 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.587 -0.845 . . . . 0.0 112.621 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.582 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 6.8 tt -64.49 -44.89 96.96 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.891 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.803 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.411 ' CE1' ' HE2' ' A' ' 77' ' ' LYS . 65.3 t80 -53.4 -52.79 58.19 Favored 'General case' 0 C--O 1.259 1.574 0 C-N-CA 125.227 1.411 . . . . 0.0 111.238 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.67 -32.26 73.72 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.808 -178.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.606 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.5 mp -70.83 -35.63 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.298 176.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 72' ' ' ILE . 22.7 mm-40 -60.03 -47.58 85.25 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 122.08 0.943 . . . . 0.0 109.703 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.1 OUTLIER -72.79 -28.12 62.4 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.521 -0.872 . . . . 0.0 112.872 178.605 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.39 -53.43 57.73 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 175.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -60.35 -41.59 93.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.941 -177.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -59.1 -53.67 55.7 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.239 176.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.9 pt-20 -71.58 -37.76 70.99 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -174.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -33.36 62.34 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 . . . . . 0 N--CA 1.476 0.861 0 CA-C-O 121.852 0.834 . . . . 0.0 109.915 178.361 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.419 HD21 ' HB3' ' A' ' 79' ' ' LEU . 50.8 tp . . . . . 0 C--O 1.189 -2.115 0 CA-C-O 119.874 -0.108 . . . . 0.0 110.783 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.412 ' HA ' ' HB3' ' B' ' 118' ' ' ASP . 59.0 tp -68.6 -40.01 80.64 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 121.334 0.588 . . . . 0.0 109.685 176.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 36.6 m -60.72 -38.1 83.97 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.14 178.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.4 m -72.27 -50.46 26.98 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-O 121.388 0.613 . . . . 0.0 111.062 174.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' B' ' 115' ' ' LEU . 3.2 t70 . . . . . 0 N--CA 1.493 1.719 0 C-N-CA 126.766 2.026 . . . . 0.0 113.941 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.439 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 25.4 ttt . . . . . 0 N--CA 1.434 -1.272 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -42.37 -53.36 4.25 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 -169.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.3 p -64.82 -50.43 66.73 Favored 'General case' 0 C--O 1.255 1.375 0 CA-C-O 121.55 0.691 . . . . 0.0 111.115 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 63.2 mt -58.0 -50.77 76.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.78 -177.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.483 HD11 HD22 ' B' ' 149' ' ' LEU . 0.0 OUTLIER -67.01 -40.37 85.41 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.276 -177.252 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 16.5 ttp180 -64.61 -58.5 6.18 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 118.954 -1.098 . . . . 0.0 111.23 -176.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.9 m -66.1 -41.1 91.07 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 -175.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -81.6 -48.05 12.26 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.349 0.499 . . . . 0.0 112.349 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.508 HD21 HD13 ' A' ' 72' ' ' ILE . 9.4 tt . . . . . 0 C--N 1.319 -0.758 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -170.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.418 ' O ' ' HD2' ' A' ' 7' ' ' HIS . 43.6 mttp . . . . . 0 N--CA 1.441 -0.901 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.43 -15.47 61.47 Favored Glycine 0 C--N 1.315 -0.639 0 O-C-N 123.428 0.455 . . . . 0.0 113.88 -174.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -72.38 -8.35 54.5 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 122.335 -0.509 . . . . 0.0 112.355 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.418 ' HD2' ' O ' ' A' ' 4' ' ' LYS . 12.5 p80 -62.4 -21.89 65.73 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.315 0.579 . . . . 0.0 110.425 178.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.17 -7.44 57.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.985 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -112.91 18.01 18.48 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.936 -178.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.57 125.48 19.05 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.23 159.24 19.52 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -176.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.435 HE21 ' HB3' ' A' ' 12' ' ' GLN . 0.6 OUTLIER -59.01 -38.21 78.71 Favored 'General case' 0 C--O 1.208 -1.096 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 170.28 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.518 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 6.6 m-20 -65.86 -31.24 72.07 Favored 'General case' 0 C--O 1.202 -1.421 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.57 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -67.55 -51.88 45.44 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 179.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.58 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.0 ptm180 -64.61 -46.78 81.15 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.209 -1.359 . . . . 0.0 112.536 -177.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.6 t -66.45 -23.19 66.24 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-O 121.275 0.56 . . . . 0.0 110.899 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.518 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 9.5 t60 -69.54 -47.35 64.01 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 176.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.806 HD23 HD21 ' A' ' 68' ' ' LEU . 5.2 mp -65.01 -41.57 95.23 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.323 -1.308 . . . . 0.0 109.898 177.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 15' ' ' ARG . 67.7 t -55.81 -48.67 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 124.115 0.966 . . . . 0.0 110.39 175.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -55.75 -48.82 74.61 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.433 178.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 37.5 mttm -65.1 -37.31 87.07 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.026 178.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.464 ' O ' HG22 ' A' ' 26' ' ' ILE . 57.2 mt -53.51 -49.33 67.79 Favored 'General case' 0 CA--C 1.502 -0.869 0 O-C-N 123.577 0.548 . . . . 0.0 109.8 175.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.499 HG11 ' HE1' ' A' ' 40' ' ' MET . 58.6 t -54.87 -51.88 48.43 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.147 0 O-C-N 124.328 1.017 . . . . 0.0 110.172 175.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -56.72 -31.94 65.02 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -177.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.672 ' HB2' ' NE2' ' A' ' 76' ' ' GLN . . . -81.14 -45.94 15.65 Favored 'General case' 0 C--O 1.215 -0.757 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 176.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.464 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -79.9 -27.38 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-O 122.055 0.931 . . . . 0.0 111.013 -173.719 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -133.17 87.37 39.27 Favored Pre-proline 0 C--N 1.285 -2.21 0 C-N-CA 124.516 1.126 . . . . 0.0 108.997 177.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -58.37 116.1 3.01 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.164 1.909 . . . . 0.0 110.48 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.2 t -88.93 132.41 38.27 Favored Pre-proline 0 N--CA 1.424 -1.741 0 CA-C-O 121.104 0.478 . . . . 0.0 111.308 -174.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.63 -28.7 13.86 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.595 2.197 . . . . 0.0 111.331 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -148.98 155.61 40.48 Favored Pre-proline 0 C--N 1.31 -1.117 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.483 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.512 ' HA ' HD12 ' A' ' 35' ' ' LEU . 57.1 Cg_endo -73.52 -7.44 20.29 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.005 1.803 . . . . 0.0 114.367 179.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.59 -20.62 26.15 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 121.519 -0.738 . . . . 0.0 110.049 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.77 -12.31 58.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.863 0.839 . . . . 0.0 110.031 174.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 32' ' ' PRO . 27.6 mt -89.53 2.14 54.99 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.029 -179.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.89 9.93 4.22 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.742 0.782 . . . . 0.0 109.432 175.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.637 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 15.7 t70 -86.78 174.28 8.9 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 124.888 1.275 . . . . 0.0 111.004 -175.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.637 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -64.69 -29.19 70.18 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 123.266 0.626 . . . . 0.0 111.17 179.454 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.537 ' O ' HD13 ' A' ' 43' ' ' LEU . 41.2 ttm180 -66.38 -37.24 84.81 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 177.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.809 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 7.5 tpp -58.06 -35.56 71.53 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.716 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.2 pt-20 -61.64 -30.98 71.07 Favored 'General case' 0 C--O 1.209 -1.077 0 C-N-CA 118.63 -1.228 . . . . 0.0 109.369 -178.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -74.8 -46.44 36.82 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.461 177.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.624 HD22 ' HA ' ' A' ' 40' ' ' MET . 1.2 mp -55.1 -58.39 7.87 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.342 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.809 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.8 p -69.59 -29.27 40.82 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.346 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.744 -176.155 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.3 -47.45 85.35 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.554 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.3 t80 -59.93 -44.83 94.11 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 174.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.42 -42.29 99.34 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.055 -177.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -65.3 -44.11 88.97 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 123.2 0.6 . . . . 0.0 111.002 178.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.554 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 53.7 pttt -65.25 -40.71 94.37 Favored 'General case' 0 C--O 1.246 0.877 0 CA-C-O 121.284 0.564 . . . . 0.0 110.623 -178.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.446 HG21 ' CE2' ' A' ' 46' ' ' TYR . 43.0 t -70.95 -44.21 75.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.953 178.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -56.89 -46.66 81.73 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.09 -34.29 88.54 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.202 177.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 30.0 t70 -61.21 -53.8 52.34 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.005 0.431 . . . . 0.0 110.326 178.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.457 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -70.35 -31.07 68.19 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -59.47 -48.82 80.18 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -76.78 -24.9 52.88 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.516 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.8 t -80.33 -11.23 59.73 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -107.53 165.63 11.27 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.975 0.416 . . . . 0.0 111.503 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -112.39 14.21 20.34 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.376 0.607 . . . . 0.0 111.529 177.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 99.6 p -162.26 153.53 17.99 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 171.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.514 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -58.59 -41.18 85.19 Favored 'General case' 0 C--O 1.192 -1.932 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.978 174.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -65.35 -39.92 92.98 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.435 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -63.53 -50.43 69.6 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.145 175.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.467 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -62.7 -44.24 96.75 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.827 -177.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.48 -46.82 88.71 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 124.166 0.916 . . . . 0.0 110.44 177.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.595 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 24.2 t60 -63.38 -50.96 67.83 Favored 'General case' 0 C--O 1.202 -1.419 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.457 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -64.68 -37.66 88.33 Favored 'General case' 0 C--O 1.276 2.493 0 CA-C-O 121.514 0.674 . . . . 0.0 111.877 -176.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.806 HD21 HD23 ' A' ' 18' ' ' LEU . 1.5 pp -69.59 -35.5 75.38 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 178.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.542 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.83 -35.5 80.83 Favored 'General case' 0 C--O 1.204 -1.298 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.747 177.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 26.6 mt-10 -66.23 -47.37 74.02 Favored 'General case' 0 C--O 1.252 1.233 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.861 -179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -40.47 87.96 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 118.578 -1.249 . . . . 0.0 110.599 -178.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.542 HG22 ' HA ' ' A' ' 69' ' ' ALA . 4.4 tt -65.74 -44.13 93.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.117 -178.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.441 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 53.9 t80 -56.39 -53.11 61.25 Favored 'General case' 0 C--O 1.273 2.304 0 C-N-CA 125.36 1.464 . . . . 0.0 110.947 -178.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.5 ptpt -63.48 -39.55 94.74 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.661 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.535 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -61.89 -39.21 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 123.343 0.402 . . . . 0.0 111.514 178.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.7 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 28.7 mm-40 -60.1 -53.48 57.28 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.452 ' HE2' ' HB3' ' A' ' 77' ' ' LYS . 6.7 ptpt -73.6 -28.78 62.0 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.469 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 8.1 tp10 -59.29 -47.94 83.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 175.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.1 pp -67.27 -37.42 83.42 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.188 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.492 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 4.7 mm-40 -61.12 -53.19 60.1 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.0 pt-20 -73.36 -32.96 64.82 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.556 ' HE2' ' HG3' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -66.07 -31.03 71.67 Favored 'General case' 0 C--N 1.352 0.674 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.095 179.081 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.556 ' HG3' ' HE2' ' A' ' 82' ' ' LYS . 51.3 mtm180 . . . . . 0 N--CA 1.454 -0.232 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.866 173.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.546 HD21 ' HB3' ' A' ' 79' ' ' LEU . 50.7 tp . . . . . 0 C--O 1.19 -2.042 0 N-CA-C 111.43 0.159 . . . . 0.0 111.43 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 55.6 tp -65.61 -33.73 76.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.104 0.478 . . . . 0.0 109.829 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 31.3 m -64.45 -45.38 87.67 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.417 175.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 13.0 m -67.77 -35.21 78.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 121.746 0.784 . . . . 0.0 110.095 176.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 6.4 t70 . . . . . 0 C--N 1.317 -0.813 0 C-N-CA 125.494 1.518 . . . . 0.0 109.903 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.507 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 44.4 ttp . . . . . 0 C--O 1.205 -1.244 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -38.24 -60.13 0.81 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 116.519 2.044 . . . . 0.0 116.519 -174.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.9 m -66.78 -39.67 87.89 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.22 0.533 . . . . 0.0 110.212 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 86.2 mt -64.98 -53.01 46.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.847 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.507 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 18.4 tt -68.37 -31.6 52.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 120.928 0.394 . . . . 0.0 112.061 -175.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -69.45 -51.52 35.38 Favored 'General case' 0 N--CA 1.419 -1.993 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.688 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 53.6 p -67.4 -42.45 83.28 Favored 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -80.62 -40.28 25.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -176.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 72' ' ' ILE . 10.0 tt . . . . . 0 C--N 1.314 -0.952 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -171.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.426 ' HB2' ' NE1' ' A' ' 6' ' ' TRP . 13.8 ptpt . . . . . 0 N--CA 1.431 -1.39 0 CA-C-O 121.52 0.676 . . . . 0.0 109.521 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.9 -20.25 1.77 Allowed Glycine 0 N--CA 1.473 1.136 0 C-N-CA 125.7 1.619 . . . . 0.0 116.842 -171.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.426 ' NE1' ' HB2' ' A' ' 4' ' ' LYS . 65.6 p-90 -66.12 -15.07 62.79 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 117.444 0.622 . . . . 0.0 111.562 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . 0.571 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 8.9 p80 -59.8 -25.08 64.65 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.171 0.588 . . . . 0.0 111.634 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -84.81 -9.33 58.27 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 120.921 0.391 . . . . 0.0 110.85 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.422 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 30.2 m-70 -88.83 -8.01 55.12 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 121.389 0.614 . . . . 0.0 109.557 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.779 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -106.17 140.97 22.54 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 N-CA-C 105.664 -1.976 . . . . 0.0 105.664 177.456 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.711 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -107.18 158.47 17.07 Favored 'General case' 0 C--N 1.276 -2.624 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -51.4 -41.49 60.76 Favored 'General case' 0 N--CA 1.438 -1.034 0 O-C-N 125.352 1.657 . . . . 0.0 109.993 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 18.7 m-20 -69.34 -39.35 78.21 Favored 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.04 179.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.572 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -63.62 -50.53 68.99 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 -179.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.711 ' HG2' ' O ' ' A' ' 11' ' ' THR 0.261 17.3 mmm-85 -51.54 -57.92 7.74 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 123.642 0.589 . . . . 0.0 109.704 175.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.0 t -66.02 -26.84 67.71 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.829 -171.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.422 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 11.0 t60 -70.54 -46.93 62.66 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.724 HD23 HD21 ' A' ' 68' ' ' LEU . 4.3 mp -68.12 -38.84 82.67 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.761 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 15' ' ' ARG . 73.7 t -56.76 -48.44 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 C-N-CA 123.618 0.767 . . . . 0.0 110.114 174.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -56.84 -49.01 76.71 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.682 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.579 ' HZ3' HG13 ' B' ' 145' ' ' ILE . 84.2 mttt -63.43 -39.83 95.52 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.769 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.482 ' O ' HG22 ' A' ' 26' ' ' ILE . 5.7 mt -51.01 -52.84 38.9 Favored 'General case' 0 CA--C 1.506 -0.75 0 O-C-N 123.99 0.806 . . . . 0.0 110.577 174.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.65 HG11 ' HE1' ' A' ' 40' ' ' MET . 59.3 t -55.54 -51.24 60.0 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.17 0 O-C-N 124.031 0.832 . . . . 0.0 110.38 176.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -54.62 -35.94 63.96 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -175.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.519 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.2 -45.54 16.18 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 178.01 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.545 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.97 -23.84 15.05 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 CA-C-O 122.251 1.024 . . . . 0.0 110.925 -174.834 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.545 ' CD2' HG23 ' A' ' 26' ' ' ILE . 63.0 m-85 -134.32 94.57 17.52 Favored Pre-proline 0 C--N 1.282 -2.358 0 C-N-CA 124.85 1.26 . . . . 0.0 107.735 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.96 89.54 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 121.906 1.737 . . . . 0.0 110.655 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.441 HG21 HD21 ' A' ' 35' ' ' LEU . 14.5 t -59.3 128.96 86.29 Favored Pre-proline 0 N--CA 1.429 -1.49 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.307 -174.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -73.78 -17.75 22.62 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 123.082 2.521 . . . . 0.0 112.059 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -160.13 146.36 11.86 Favored Pre-proline 0 CA--C 1.492 -1.282 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -61.35 -19.01 62.35 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 121.997 1.798 . . . . 0.0 113.913 176.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.05 -11.84 59.74 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.5 -0.88 . . . . 0.0 111.818 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.05 -6.61 53.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.862 0.839 . . . . 0.0 109.523 175.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.484 ' O ' ' HG2' ' A' ' 40' ' ' MET . 24.6 mt -91.36 0.9 57.45 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.059 -178.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -133.3 18.8 4.01 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 122.195 0.998 . . . . 0.0 108.63 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.587 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 27.9 t70 -96.29 177.18 5.79 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 113.811 -1.541 . . . . 0.0 112.041 -173.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.587 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.96 -25.11 62.58 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 124.203 1.001 . . . . 0.0 111.058 179.173 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.589 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 43.0 ttm180 -76.11 -27.84 57.25 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 176.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.839 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 10.7 tpp -59.02 -36.64 75.3 Favored 'General case' 0 C--O 1.197 -1.675 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.167 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 9.4 pt-20 -59.24 -32.97 70.46 Favored 'General case' 0 C--O 1.189 -2.103 0 C-N-CA 119.558 -0.857 . . . . 0.0 109.952 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.417 HD22 HD23 ' A' ' 43' ' ' LEU . 4.7 t30 -76.57 -43.33 39.32 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 123.23 0.612 . . . . 0.0 110.465 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.0 mt -63.26 -48.62 77.44 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.199 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.839 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.3 p -73.28 -28.33 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.719 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.137 -178.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -59.81 -45.67 91.64 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.58 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 13.0 t80 -61.79 -47.86 83.23 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.917 174.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.06 -43.05 91.67 Favored 'General case' 0 C--O 1.203 -1.372 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.234 -178.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -66.06 -39.96 90.51 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 123.7 0.8 . . . . 0.0 112.181 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -69.84 -37.36 76.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.359 0.599 . . . . 0.0 109.712 -178.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.414 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 65.3 t -70.98 -50.0 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.101 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.404 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.5 tm-20 -57.11 -46.79 82.33 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.964 0.906 . . . . 0.0 109.575 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.67 -40.47 98.04 Favored Glycine 0 CA--C 1.507 -0.413 0 O-C-N 123.587 0.555 . . . . 0.0 112.235 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -59.66 -54.34 47.58 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 122.785 0.434 . . . . 0.0 110.799 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.518 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.99 -34.17 77.81 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 178.118 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.571 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 68.1 t80 -59.48 -52.74 64.28 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 174.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.84 -18.55 61.44 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-O 121.705 0.764 . . . . 0.0 111.837 -179.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.464 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 17.4 m -85.46 -27.16 25.89 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -87.55 167.23 14.12 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -176.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.426 HD22 ' C ' ' A' ' 59' ' ' ASN . 0.2 OUTLIER -108.6 5.83 25.37 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.641 177.559 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.519 ' HB2' ' OD1' ' A' ' 62' ' ' ASP . 42.0 p -169.87 154.33 5.22 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 178.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.779 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -62.46 -36.24 81.82 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-O 121.247 0.546 . . . . 0.0 110.51 179.859 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.519 ' OD1' ' HB2' ' A' ' 60' ' ' SER . 1.2 p-10 -62.79 -38.62 91.4 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 124.548 1.139 . . . . 0.0 111.202 177.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -70.57 -44.35 67.58 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.705 0.288 . . . . 0.0 110.874 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.454 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -66.28 -43.83 85.26 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.331 -177.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.64 -40.11 93.72 Favored 'General case' 0 C--O 1.199 -1.566 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.514 176.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -60.2 -57.73 11.57 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.238 0.336 . . . . 0.0 111.633 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.518 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.7 pp -69.1 -30.43 68.72 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.717 -174.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.724 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -76.08 -32.57 59.31 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 119.85 -0.74 . . . . 0.0 109.073 178.366 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.527 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -66.47 -36.8 83.66 Favored 'General case' 0 C--O 1.206 -1.234 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.37 -44.14 92.34 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.757 177.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.517 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.96 -39.05 79.71 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 119.966 -0.694 . . . . 0.0 111.137 179.011 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.527 HG22 ' HA ' ' A' ' 69' ' ' ALA . 10.5 tt -68.91 -40.61 81.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.302 -179.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.558 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.1 t80 -57.49 -51.22 70.33 Favored 'General case' 0 C--O 1.261 1.669 0 C-N-CA 124.711 1.204 . . . . 0.0 111.303 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.53 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.8 ptpt -63.53 -40.6 97.44 Favored 'General case' 0 C--O 1.199 -1.565 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.519 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.5 mp -60.7 -38.77 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 O-C-N 123.717 0.636 . . . . 0.0 111.01 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.526 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 28.1 mt-30 -69.26 -45.0 70.8 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 120.265 -0.574 . . . . 0.0 111.855 -177.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.583 ' HA ' ' HG2' ' A' ' 80' ' ' GLU . 10.9 ptpt -74.35 -27.6 60.75 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 118.858 -1.137 . . . . 0.0 112.362 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 7.1 tp10 -61.02 -49.2 78.38 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 174.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.591 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.5 pp -65.9 -42.13 90.63 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -177.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.583 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 9.6 pt-20 -69.48 -39.18 77.81 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 119.444 -0.903 . . . . 0.0 112.652 -177.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -69.44 -39.59 77.73 Favored 'General case' 0 C--O 1.213 -0.817 0 C-N-CA 118.877 -1.129 . . . . 0.0 110.534 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.552 ' HD3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -69.25 -31.66 70.35 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 120.564 -0.454 . . . . 0.0 111.016 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.42 ' HG2' ' HE2' ' A' ' 82' ' ' LYS . 5.5 mmt180 . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.913 178.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.591 HD21 ' HB3' ' A' ' 79' ' ' LEU . 56.0 tp . . . . . 0 C--O 1.208 -1.123 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.552 HD13 ' HD3' ' A' ' 82' ' ' LYS . 61.8 tp -71.22 -38.4 72.0 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.372 -0.83 . . . . 0.0 110.463 178.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 3.1 t -71.32 -35.84 71.37 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 119.834 -0.746 . . . . 0.0 111.644 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.1 p -69.84 -33.33 72.15 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.595 0.712 . . . . 0.0 109.874 175.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 11.9 t70 . . . . . 0 C--N 1.318 -0.794 0 C-N-CA 124.621 1.168 . . . . 0.0 109.976 176.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.592 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 21.1 ttt . . . . . 0 C--O 1.204 -1.305 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -34.26 -59.99 0.42 Allowed 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -172.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.4 m -69.22 -38.3 78.48 Favored 'General case' 0 C--O 1.253 1.247 0 CA-C-O 121.587 0.708 . . . . 0.0 110.43 -176.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 58.6 mt -69.94 -46.77 72.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.415 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.592 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 0.0 OUTLIER -63.56 -36.65 77.16 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.76 -179.051 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -61.4 -65.41 0.7 Allowed 'General case' 0 N--CA 1.428 -1.575 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.395 178.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.2 p -64.2 -54.02 40.08 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -173.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -80.78 -35.14 33.56 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -173.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.466 HD21 HD13 ' A' ' 72' ' ' ILE . 10.1 tt . . . . . 0 N--CA 1.441 -0.917 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -171.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.429 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 10.8 ptpt . . . . . 0 N--CA 1.444 -0.744 0 CA-C-O 121.557 0.694 . . . . 0.0 110.772 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.18 -22.28 13.6 Favored Glycine 0 CA--C 1.521 0.44 0 CA-C-N 114.338 -1.301 . . . . 0.0 115.83 -175.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.429 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 56.9 p-90 -64.37 -9.41 17.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 117.734 0.767 . . . . 0.0 112.279 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -62.58 -17.04 59.27 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 122.382 0.273 . . . . 0.0 111.621 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -86.44 -10.5 54.1 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.268 0.556 . . . . 0.0 110.359 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.414 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 24.7 m-70 -87.98 5.94 38.33 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.68 0.752 . . . . 0.0 109.575 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.606 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -133.51 114.01 19.86 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.703 0 N-CA-C 105.285 -2.117 . . . . 0.0 105.285 178.564 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.72 174.74 7.84 Favored 'General case' 0 C--N 1.276 -2.592 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -28.79 70.33 Favored 'General case' 0 C--O 1.202 -1.399 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -57.72 -48.25 80.11 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 178.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.553 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -66.4 -54.45 24.21 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -175.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.541 ' O ' HG23 ' A' ' 19' ' ' VAL . 2.8 ptm180 -60.9 -45.16 95.7 Favored 'General case' 0 N--CA 1.42 -1.956 0 CA-C-N 114.629 -1.169 . . . . 0.0 113.996 -178.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.1 t -65.3 -30.35 71.2 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 117.816 0.28 . . . . 0.0 110.756 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -66.31 -45.16 81.27 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.834 HD23 HD21 ' A' ' 68' ' ' LEU . 6.3 mp -66.33 -40.23 89.75 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.497 178.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.5 t -58.98 -49.75 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 124.022 0.929 . . . . 0.0 110.271 175.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -54.84 -44.13 73.66 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.969 0.908 . . . . 0.0 110.04 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -67.96 -41.64 82.14 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.103 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.452 ' O ' HG22 ' A' ' 26' ' ' ILE . 55.5 mt -51.91 -48.03 64.36 Favored 'General case' 0 CA--C 1.501 -0.909 0 O-C-N 123.515 0.509 . . . . 0.0 110.025 175.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.514 HG11 ' HE1' ' A' ' 40' ' ' MET . 41.8 t -55.81 -55.42 17.91 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.881 0 O-C-N 124.284 0.99 . . . . 0.0 110.471 175.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -57.21 -29.7 63.95 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -176.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.401 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -81.48 -45.91 15.3 Favored 'General case' 0 C--O 1.21 -1.007 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 176.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.452 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.86 -26.31 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-O 121.961 0.886 . . . . 0.0 110.141 -174.461 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.509 ' CG ' HD22 ' A' ' 43' ' ' LEU . 14.4 m-85 -138.81 88.09 14.07 Favored Pre-proline 0 N--CA 1.418 -2.058 0 C-N-CA 125.394 1.477 . . . . 0.0 108.717 177.147 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -57.09 106.33 0.22 Allowed 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 121.74 1.626 . . . . 0.0 109.214 177.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.0 t -66.85 130.08 94.0 Favored Pre-proline 0 N--CA 1.422 -1.833 0 CA-C-O 121.161 0.505 . . . . 0.0 111.164 -174.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.91 -31.6 12.42 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.534 2.156 . . . . 0.0 111.696 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -144.81 148.1 37.94 Favored Pre-proline 0 CA--C 1.49 -1.344 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 -176.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -69.12 -12.98 35.44 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.566 1.511 . . . . 0.0 112.286 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.64 -14.53 48.35 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.408 177.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.83 -11.19 60.5 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.877 0.846 . . . . 0.0 109.037 176.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.448 ' HA ' ' CE ' ' A' ' 40' ' ' MET . 23.9 mt -86.92 5.47 36.9 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.414 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -136.12 6.64 3.11 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.82 -0.55 . . . . 0.0 111.556 173.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.642 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 30.9 t70 -81.31 177.56 8.92 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.698 -176.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.642 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.93 -19.3 62.59 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.566 0.698 . . . . 0.0 110.468 175.225 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.62 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 17.3 tpp180 -70.3 -31.94 69.5 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.572 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -57.95 -41.01 81.95 Favored 'General case' 0 CA--C 1.478 -1.803 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.149 -179.424 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 7.7 pt-20 -60.15 -33.98 72.91 Favored 'General case' 0 C--O 1.208 -1.122 0 O-C-N 123.785 0.678 . . . . 0.0 110.763 -175.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.533 HD22 HD23 ' A' ' 43' ' ' LEU . 6.9 t30 -73.6 -44.66 56.58 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.38 0.609 . . . . 0.0 109.901 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 8.8 mt -65.53 -45.73 82.35 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.262 -176.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 40' ' ' MET . 29.1 m -69.33 -31.45 49.6 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.139 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.205 178.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.56 -45.2 89.48 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 177.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.52 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.4 t80 -63.17 -48.6 77.72 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.57 0.544 . . . . 0.0 110.373 173.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.83 -42.04 88.29 Favored 'General case' 0 C--O 1.201 -1.499 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.188 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -68.36 -41.12 81.1 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 123.843 0.857 . . . . 0.0 111.669 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.52 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 57.3 pttt -67.06 -39.33 86.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.728 0.775 . . . . 0.0 109.546 -178.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.466 HG21 ' CE2' ' A' ' 46' ' ' TYR . 42.9 t -72.54 -45.9 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.14 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.7 tm-20 -58.02 -47.53 82.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 177.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.89 -39.35 95.38 Favored Glycine 0 N--CA 1.449 -0.48 0 O-C-N 123.646 0.591 . . . . 0.0 112.436 178.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -59.09 -54.26 49.03 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 123.703 0.801 . . . . 0.0 110.741 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.484 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.4 OUTLIER -69.98 -28.33 65.45 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 178.123 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -66.25 -47.55 73.4 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -73.48 -26.4 60.89 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.187 0.517 . . . . 0.0 111.334 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.484 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 25.6 m -75.89 -33.04 59.92 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.27 170.39 15.45 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.432 0.634 . . . . 0.0 112.237 -178.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -120.18 13.15 11.98 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.423 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.8 p -166.86 152.85 8.15 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.606 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -64.75 -27.4 68.87 Favored 'General case' 0 C--O 1.204 -1.328 0 C-N-CA 118.43 -1.308 . . . . 0.0 110.22 175.328 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -63.07 -47.71 81.75 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.78 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.1 -44.27 89.36 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.317 176.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.408 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.83 -45.35 86.51 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.583 -177.046 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.54 -41.99 98.16 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.215 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.4 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 43.6 t-80 -60.66 -52.69 64.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 70' ' ' GLU . 4.5 pp -72.04 -33.74 68.22 Favored 'General case' 0 C--O 1.264 1.848 0 CA-C-O 121.305 0.574 . . . . 0.0 111.969 -175.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.834 HD21 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -70.76 -36.5 73.13 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 179.2 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.549 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -60.94 -39.87 91.08 Favored 'General case' 0 C--O 1.188 -2.151 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.316 175.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 42.5 mm-40 -55.77 -51.37 67.64 Favored 'General case' 0 C--O 1.253 1.282 0 C-N-CA 122.697 0.399 . . . . 0.0 111.704 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.81 -39.01 76.79 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 118.63 -1.228 . . . . 0.0 111.924 -177.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.549 HG22 ' HA ' ' A' ' 69' ' ' ALA . 8.4 tt -67.65 -45.19 85.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.662 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.556 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 47.7 t80 -54.95 -51.88 64.75 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 125.571 1.548 . . . . 0.0 110.684 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.405 ' NZ ' ' HB3' ' A' ' 74' ' ' LYS . 0.4 OUTLIER -63.21 -41.22 99.12 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 120.471 -0.492 . . . . 0.0 110.53 -179.387 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.401 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.3 mp -62.83 -35.05 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 O-C-N 123.177 0.298 . . . . 0.0 111.45 178.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.525 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 5.1 mt-30 -70.75 -44.29 67.08 Favored 'General case' 0 CA--C 1.483 -1.634 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.867 -177.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.556 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 12.4 ptpt -74.55 -27.4 60.5 Favored 'General case' 0 N--CA 1.418 -2.027 0 C-N-CA 119.017 -1.073 . . . . 0.0 111.898 176.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.415 ' HA ' ' HG2' ' A' ' 81' ' ' GLU . 25.4 tt0 -67.46 -42.71 82.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 176.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.64 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.5 pp -65.98 -39.34 90.27 Favored 'General case' 0 C--O 1.212 -0.878 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.088 177.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -58.4 -52.72 64.44 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 123.726 0.641 . . . . 0.0 111.111 176.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.415 ' HG2' ' HA ' ' A' ' 78' ' ' GLU . 10.8 pt-20 -64.41 -43.23 95.02 Favored 'General case' 0 C--O 1.211 -0.926 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.982 -178.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.409 ' C ' ' HD2' ' A' ' 82' ' ' LYS . 0.2 OUTLIER -67.4 -33.47 75.25 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.122 0.486 . . . . 0.0 110.677 -177.799 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.622 -179.017 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.64 HD21 ' HB3' ' A' ' 79' ' ' LEU . 26.5 tp . . . . . 0 N--CA 1.448 -0.563 0 CA-C-O 121.259 0.552 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 40.2 tp -70.12 -33.42 71.81 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 32.3 m -64.64 -43.09 94.8 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 174.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . 0.408 ' HB3' ' HA ' ' A' ' 27' ' ' PHE . 17.6 m -61.58 -41.99 98.2 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.429 0.633 . . . . 0.0 109.761 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.4 t70 . . . . . 0 C--N 1.323 -0.552 0 C-N-CA 124.144 0.977 . . . . 0.0 110.788 176.867 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.409 ' HE2' ' HB ' ' B' ' 145' ' ' ILE . 16.0 ptm . . . . . 0 C--O 1.209 -1.049 0 N-CA-C 111.157 0.058 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -10.4 -74.18 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 128.196 2.598 . . . . 0.0 115.554 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 5.7 m -66.54 -47.48 72.74 Favored 'General case' 0 C--O 1.253 1.251 0 C-N-CA 123.589 0.756 . . . . 0.0 112.191 -175.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 62.5 mt -65.62 -44.49 93.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.887 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.409 ' HB ' ' HE2' ' B' ' 141' ' ' MET . 12.0 tt -67.49 -36.63 76.92 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.481 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.855 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 45.6 ttt180 -55.71 -50.5 70.14 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.9 m -60.97 -51.86 67.46 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.651 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -76.52 -43.32 39.88 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -174.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.519 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 2.5 tm? . . . . . 0 C--N 1.296 -1.741 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.721 -172.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.453 ' HD2' ' HE1' ' A' ' 6' ' ' TRP . 28.8 mtmm . . . . . 0 N--CA 1.426 -1.65 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -52.2 -25.1 17.56 Favored Glycine 0 C--O 1.243 0.709 0 N-CA-C 116.023 1.169 . . . . 0.0 116.023 -172.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.453 ' HE1' ' HD2' ' A' ' 4' ' ' LYS . 66.2 p-90 -66.59 -14.72 62.75 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 117.412 0.606 . . . . 0.0 112.009 178.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -59.39 -14.12 10.92 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 177.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -84.86 -10.26 57.31 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.46 0.648 . . . . 0.0 110.422 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -95.04 3.58 54.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.211 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.0 p -134.74 125.85 46.75 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.021 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.459 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -93.84 157.83 15.94 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.52 -177.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.413 HE21 ' HB3' ' A' ' 12' ' ' GLN . 0.0 OUTLIER -52.42 -43.05 64.6 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.071 0.948 . . . . 0.0 110.049 175.857 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.415 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 1.9 m-20 -57.47 -37.23 72.55 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.245 -0.888 . . . . 0.0 112.191 -179.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.479 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -70.4 -51.45 29.48 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 -176.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.497 ' O ' HG23 ' A' ' 19' ' ' VAL . 3.9 ptm180 -66.17 -43.73 86.08 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.447 -1.251 . . . . 0.0 113.164 -176.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.5 t -68.42 -24.46 64.74 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-O 121.181 0.515 . . . . 0.0 109.672 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 20.2 t60 -68.92 -44.58 72.84 Favored 'General case' 0 C--O 1.246 0.915 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 176.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.766 HD23 HD21 ' A' ' 68' ' ' LEU . 3.7 mp -65.78 -40.65 92.2 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.705 -1.134 . . . . 0.0 110.171 177.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 15' ' ' ARG . 60.6 t -55.69 -48.46 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.602 0.761 . . . . 0.0 110.101 174.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -53.65 -50.43 65.78 Favored 'General case' 0 C--O 1.249 1.053 0 C-N-CA 123.622 0.769 . . . . 0.0 110.607 177.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -64.14 -39.8 94.8 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.814 178.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.522 ' O ' HG22 ' A' ' 26' ' ' ILE . 20.2 mt -50.96 -53.34 33.87 Favored 'General case' 0 CA--C 1.505 -0.782 0 O-C-N 123.797 0.686 . . . . 0.0 110.559 175.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.461 HG11 ' HE1' ' A' ' 40' ' ' MET . 54.7 t -54.8 -50.11 63.77 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.766 0 O-C-N 124.173 0.921 . . . . 0.0 110.786 176.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -55.34 -38.79 69.23 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -177.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.443 ' HB3' HG13 ' A' ' 72' ' ' ILE . . . -81.16 -44.56 17.7 Favored 'General case' 0 C--O 1.206 -1.235 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.834 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.597 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.22 -25.92 16.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.529 0.681 . . . . 0.0 110.725 -175.0 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.597 ' CD2' HG23 ' A' ' 26' ' ' ILE . 62.9 m-85 -128.54 91.51 43.41 Favored Pre-proline 0 C--N 1.293 -1.888 0 C-N-CA 123.858 0.863 . . . . 0.0 109.446 178.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.84 97.52 0.18 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 122.081 1.854 . . . . 0.0 110.172 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.6 t -69.73 138.37 88.17 Favored Pre-proline 0 N--CA 1.424 -1.762 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.512 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.53 -34.99 8.63 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 122.515 2.143 . . . . 0.0 111.376 178.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -142.92 150.84 54.58 Favored Pre-proline 0 CA--C 1.489 -1.381 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -65.82 -13.39 39.6 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.1 1.866 . . . . 0.0 112.088 175.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.4 -9.71 55.76 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.369 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.37 -8.77 59.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.378 1.085 . . . . 0.0 108.564 176.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.426 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.2 mt -85.6 1.57 48.61 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 114.033 -1.439 . . . . 0.0 110.291 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -133.32 20.07 4.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 122.2 1.0 . . . . 0.0 108.699 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.688 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 27.1 t70 -98.03 177.09 5.53 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.642 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.688 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -68.69 -29.03 67.38 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.725 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.582 ' O ' HD13 ' A' ' 43' ' ' LEU . 4.3 tpm_? -63.95 -34.45 78.0 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.653 ' HA ' HD22 ' A' ' 43' ' ' LEU . 5.9 tpp -58.54 -32.73 69.15 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 114.266 -1.334 . . . . 0.0 112.724 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -64.36 -31.61 72.89 Favored 'General case' 0 C--O 1.203 -1.358 0 C-N-CA 118.727 -1.189 . . . . 0.0 109.845 -178.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -72.77 -46.08 55.24 Favored 'General case' 0 CA--C 1.5 -0.949 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 175.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.653 HD22 ' HA ' ' A' ' 40' ' ' MET . 1.7 mp -53.19 -55.97 20.04 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 113.928 -1.487 . . . . 0.0 110.744 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.617 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.0 p -73.26 -29.08 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.034 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.571 -175.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.79 -47.67 84.78 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.534 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.0 t80 -61.15 -46.56 90.01 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.148 175.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.48 -44.45 93.04 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 120.854 -0.339 . . . . 0.0 111.21 -177.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -62.83 -46.24 88.83 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 123.32 0.648 . . . . 0.0 111.829 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.5 pttp -63.55 -41.84 98.41 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-O 121.306 0.574 . . . . 0.0 110.605 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.512 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 50.8 t -70.47 -43.56 77.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.053 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -58.48 -44.6 89.4 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.7 -42.49 96.34 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.179 178.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.35 -54.62 44.66 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.491 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -67.02 -30.21 70.24 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 179.612 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.6 -50.74 63.98 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -69.4 -25.12 63.98 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.246 -0.434 . . . . 0.0 112.07 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.464 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 34.5 m -79.18 -27.25 42.63 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 124.408 1.083 . . . . 0.0 113.431 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.19 162.82 16.47 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -110.71 8.32 22.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.54 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.6 p -162.49 157.97 23.02 Favored 'General case' 0 CA--C 1.487 -1.452 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 174.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.1 -26.45 62.15 Favored 'General case' 0 C--O 1.2 -1.515 0 C-N-CA 118.921 -1.112 . . . . 0.0 110.131 178.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -64.72 -45.3 87.13 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.502 176.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -63.26 -44.56 94.81 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.022 175.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -46.45 79.18 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.694 -177.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.86 -44.79 96.12 Favored 'General case' 0 C--O 1.209 -1.056 0 O-C-N 123.839 0.712 . . . . 0.0 110.318 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.479 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 13.8 t60 -65.46 -47.16 77.09 Favored 'General case' 0 C--O 1.209 -1.038 0 O-C-N 123.157 0.286 . . . . 0.0 111.475 -177.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.477 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.0 pp -70.5 -33.23 70.98 Favored 'General case' 0 C--O 1.255 1.381 0 C-N-CA 120.256 -0.578 . . . . 0.0 111.528 -176.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.766 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -73.23 -33.6 65.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 178.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.594 ' O ' ' HB2' ' A' ' 73' ' ' TYR . . . -63.7 -41.97 98.04 Favored 'General case' 0 C--O 1.183 -2.439 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.906 175.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 38.3 mm-40 -57.11 -47.37 81.25 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-O 121.462 0.649 . . . . 0.0 111.314 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.504 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -70.23 -38.62 75.26 Favored 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.908 -178.149 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.524 HG22 ' HA ' ' A' ' 69' ' ' ALA . 9.4 tt -69.68 -36.57 71.0 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-O 121.765 0.793 . . . . 0.0 109.794 -179.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.594 ' HB2' ' O ' ' A' ' 69' ' ' ALA . 16.9 t80 -58.55 -55.44 34.99 Favored 'General case' 0 C--O 1.279 2.646 0 C-N-CA 126.656 1.983 . . . . 0.0 109.826 -178.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.7 ptpt -64.87 -33.14 75.29 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.793 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -68.11 -41.79 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 O-C-N 123.481 0.488 . . . . 0.0 111.905 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.574 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 29.1 mt-30 -62.42 -49.01 77.17 Favored 'General case' 0 C--O 1.262 1.745 0 CA-C-O 121.198 0.523 . . . . 0.0 111.253 -178.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.2 ptpt -69.33 -31.18 69.46 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 118.75 -1.18 . . . . 0.0 111.848 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 11.4 tp10 -64.99 -47.53 77.19 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.602 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.5 pp -60.4 -43.72 96.41 Favored 'General case' 0 CA--C 1.492 -1.285 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.493 -177.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.427 ' N ' HD12 ' A' ' 79' ' ' LEU . 11.5 pt-20 -67.1 -39.15 86.66 Favored 'General case' 0 C--O 1.258 1.52 0 C-N-CA 119.35 -0.94 . . . . 0.0 112.214 -178.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -73.8 -39.26 64.23 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 119.892 -0.723 . . . . 0.0 112.211 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.493 ' C ' ' HD2' ' A' ' 82' ' ' LYS . 0.2 OUTLIER -73.44 -31.93 64.1 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 110.971 -179.429 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 . . . . . 0 CA--C 1.506 -0.74 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.118 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 79' ' ' LEU . 58.3 tp . . . . . 0 C--O 1.233 0.235 0 CA-C-O 120.969 0.414 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 35.0 tp -70.69 -31.05 67.8 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 89.9 m -67.44 -43.04 82.13 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 175.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 15.0 m -57.98 -46.37 85.28 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.708 0.765 . . . . 0.0 110.408 176.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 13.1 t70 . . . . . 0 C--N 1.313 -1.012 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.745 -179.707 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.4 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 5.0 ttt . . . . . 0 C--O 1.168 -3.204 0 N-CA-C 114.52 1.304 . . . . 0.0 114.52 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.481 ' CD ' ' H ' ' B' ' 142' ' ' GLU . 1.6 mp0 -30.14 -65.61 0.11 Allowed 'General case' 0 N--CA 1.503 2.176 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 -170.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 9.1 p -68.7 -37.97 79.94 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.407 0.622 . . . . 0.0 111.017 -177.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 42.7 mm -64.39 -48.05 86.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.94 -179.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.4 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 10.0 tp -65.6 -42.04 92.02 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.443 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.356 -176.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -62.78 -56.35 18.31 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 119.018 -1.073 . . . . 0.0 111.028 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 25.5 t -62.66 -50.93 69.24 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.519 -173.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -80.67 -37.02 31.58 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -174.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.585 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 2.3 tm? . . . . . 0 CA--C 1.53 0.208 0 CA-C-O 118.444 -0.788 . . . . 0.0 111.699 -175.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.5 mttp . . . . . 0 N--CA 1.424 -1.766 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.21 -20.76 44.66 Favored Glycine 0 C--N 1.313 -0.721 0 O-C-N 124.045 0.841 . . . . 0.0 114.533 -174.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -69.58 -8.97 51.96 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 178.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.01 -20.4 66.48 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -80.85 -8.54 59.74 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.265 0.555 . . . . 0.0 110.431 178.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -103.54 5.15 36.52 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 121.464 0.649 . . . . 0.0 111.198 -176.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.8 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.9 OUTLIER -122.13 120.43 61.3 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.714 0 N-CA-C 105.132 -2.173 . . . . 0.0 105.132 175.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.5 m -74.6 149.7 39.96 Favored 'General case' 0 N--CA 1.407 -2.591 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.27 -38.18 85.83 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.07 -30.72 71.29 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.29 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.468 ' O ' HD13 ' A' ' 18' ' ' LEU . 2.7 tm? -75.45 -53.68 8.28 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.523 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.2 ptm180 -56.44 -44.99 81.01 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 176.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.4 t -69.37 -25.86 64.38 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 121.291 -0.163 . . . . 0.0 110.912 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.471 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 30.6 t60 -70.38 -37.11 74.48 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.602 HD23 HD21 ' A' ' 68' ' ' LEU . 1.7 mp -66.13 -42.72 88.74 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.49 175.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.9 t -55.83 -50.72 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.896 0.878 . . . . 0.0 109.878 174.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -52.51 -47.15 66.82 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.738 176.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.471 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 61.4 mttm -66.98 -40.15 87.35 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.76 178.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.493 ' O ' HG22 ' A' ' 26' ' ' ILE . 64.9 mt -51.8 -51.06 59.2 Favored 'General case' 0 CA--C 1.506 -0.73 0 O-C-N 123.901 0.751 . . . . 0.0 110.252 175.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.645 HG11 ' HE1' ' A' ' 40' ' ' MET . 78.1 t -54.55 -53.14 33.87 Favored 'Isoleucine or valine' 0 C--O 1.186 -2.283 0 O-C-N 124.164 0.915 . . . . 0.0 110.258 176.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.418 HE21 ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -53.74 -36.41 62.29 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -176.545 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.48 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.79 -45.71 15.22 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 177.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.523 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.77 -26.37 16.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.832 0.825 . . . . 0.0 110.49 -174.698 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.523 ' CD2' HG23 ' A' ' 26' ' ' ILE . 50.6 m-85 -130.69 93.52 31.51 Favored Pre-proline 0 C--N 1.285 -2.23 0 C-N-CA 124.187 0.995 . . . . 0.0 109.877 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.438 ' CG ' ' HA ' ' B' ' 118' ' ' ASP . 35.9 Cg_endo -65.88 109.01 1.39 Allowed 'Trans proline' 0 C--O 1.249 1.027 0 C-N-CA 121.7 1.6 . . . . 0.0 109.904 176.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.4 t -76.07 140.14 69.71 Favored Pre-proline 0 N--CA 1.43 -1.426 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.196 -174.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -72.21 -36.2 5.89 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.336 2.024 . . . . 0.0 111.101 176.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -146.97 146.3 25.48 Favored Pre-proline 0 C--N 1.313 -1.001 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 -176.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.41 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 9.9 Cg_endo -55.39 -24.11 41.59 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 122.413 2.076 . . . . 0.0 114.132 175.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.47 -11.49 59.85 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.082 -1.011 . . . . 0.0 111.856 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.0 -9.15 58.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.665 0.745 . . . . 0.0 109.557 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 40' ' ' MET . 18.1 mt -90.15 -5.55 56.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.085 -0.962 . . . . 0.0 110.39 -178.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -133.81 33.16 3.47 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.648 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 32.5 t70 -112.13 176.59 4.96 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 113.76 -1.564 . . . . 0.0 110.65 -173.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.648 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.28 -25.59 62.51 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-O 121.196 0.522 . . . . 0.0 110.635 176.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.554 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 5.2 tpm_? -71.15 -30.83 66.94 Favored 'General case' 0 C--O 1.252 1.219 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 176.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.814 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.5 tpp -58.25 -39.91 80.39 Favored 'General case' 0 C--O 1.197 -1.66 0 CA-C-N 114.483 -1.235 . . . . 0.0 112.683 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.9 pt-20 -59.05 -30.38 68.01 Favored 'General case' 0 C--O 1.205 -1.281 0 C-N-CA 119.521 -0.871 . . . . 0.0 110.919 -177.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.438 HD22 HD23 ' A' ' 43' ' ' LEU . 4.5 t30 -74.77 -46.18 38.77 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.287 0.565 . . . . 0.0 109.902 176.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.2 mt -60.2 -51.14 70.86 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.715 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.814 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -71.88 -27.88 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.646 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.376 -178.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.49 -46.68 86.19 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.523 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 7.5 t80 -59.76 -47.1 87.02 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.4 174.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.49 97.83 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 120.369 -0.533 . . . . 0.0 111.306 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -65.14 -45.81 83.49 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.206 0.602 . . . . 0.0 111.34 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.523 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 56.5 pttt -63.71 -38.04 89.63 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-O 121.726 0.774 . . . . 0.0 110.321 -178.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.494 HG21 ' CE1' ' A' ' 46' ' ' TYR . 39.9 t -73.82 -42.84 53.9 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.225 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.134 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.429 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 15.0 tm-20 -58.6 -44.4 89.88 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.55 -43.51 97.55 Favored Glycine 0 CA--C 1.501 -0.783 0 O-C-N 123.626 0.579 . . . . 0.0 111.949 177.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -55.48 -54.36 44.79 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 123.025 0.53 . . . . 0.0 111.718 177.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.48 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -70.76 -29.77 66.09 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -64.64 -49.84 69.43 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 177.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -76.33 -14.23 60.11 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.22 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.1 t -86.77 -17.72 32.84 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.848 0.356 . . . . 0.0 110.106 176.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.43 171.81 8.16 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-O 121.225 0.536 . . . . 0.0 112.045 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -124.02 14.6 9.18 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.723 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 82.5 p -167.9 156.59 9.29 Favored 'General case' 0 CA--C 1.486 -1.505 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 175.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.8 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -67.36 -31.32 71.49 Favored 'General case' 0 C--O 1.189 -2.128 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.625 175.03 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -58.78 -47.88 83.18 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 123.725 0.641 . . . . 0.0 110.499 178.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -65.96 -45.12 82.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.57 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.421 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -66.11 -46.46 77.51 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.856 -176.463 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -60.62 -44.29 96.5 Favored 'General case' 0 C--O 1.204 -1.323 0 C-N-CA 123.831 0.852 . . . . 0.0 109.283 177.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.471 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 7.4 t60 -58.88 -57.32 13.58 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 123.261 0.624 . . . . 0.0 110.925 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.476 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.2 pp -68.03 -33.21 74.16 Favored 'General case' 0 C--O 1.258 1.537 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -173.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.602 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -72.34 -37.78 68.78 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 179.573 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.597 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -60.39 -40.11 89.72 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.552 176.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 55.7 mm-40 -60.78 -46.11 91.75 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.01 178.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -42.5 75.3 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 118.769 -1.172 . . . . 0.0 111.23 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.518 HG22 ' HA ' ' A' ' 69' ' ' ALA . 5.5 tt -63.13 -42.26 95.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.751 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -57.19 -52.97 63.18 Favored 'General case' 0 C--O 1.274 2.366 0 C-N-CA 125.054 1.342 . . . . 0.0 110.379 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.6 -32.06 73.44 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.571 -178.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.48 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -68.1 -37.12 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 123.007 0.523 . . . . 0.0 111.11 178.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.565 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 34.9 mt-30 -65.59 -45.67 82.3 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 121.189 0.519 . . . . 0.0 110.751 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.474 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -70.32 -27.88 64.72 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 118.472 -1.291 . . . . 0.0 113.034 175.605 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -63.44 -48.42 77.81 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 175.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.6 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.7 pp -62.9 -40.46 97.64 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.06 -178.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.433 ' N ' HD12 ' A' ' 79' ' ' LEU . 0.7 OUTLIER -60.39 -53.33 58.9 Favored 'General case' 0 N--CA 1.412 -2.344 0 O-C-N 123.956 0.785 . . . . 0.0 110.467 -179.61 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -72.35 -33.17 67.09 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 118.982 -1.087 . . . . 0.0 112.54 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.426 ' HE3' ' CG ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -67.21 -34.14 76.87 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.396 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.713 178.96 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.6 HD21 ' HB3' ' A' ' 79' ' ' LEU . 36.9 tp . . . . . 0 C--O 1.219 -0.529 0 CA-C-O 120.829 0.347 . . . . 0.0 111.908 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.0 tp -74.89 -44.36 49.27 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 173.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 42.2 m -68.9 -36.68 78.33 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 114.506 -1.224 . . . . 0.0 111.062 -179.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . 0.546 ' OG ' ' HA ' ' B' ' 114' ' ' LEU . 68.2 p -75.95 -34.98 59.85 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.011 0.434 . . . . 0.0 110.108 178.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 20.6 t70 . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 121.597 0.713 . . . . 0.0 109.409 175.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.485 ' O ' HG12 ' B' ' 145' ' ' ILE . 19.4 ttt . . . . . 0 N--CA 1.418 -2.068 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 41.3 mt-10 -55.61 -42.25 74.62 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -174.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.4 p -59.26 -51.65 69.06 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.36 0.6 . . . . 0.0 110.722 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 41.1 mt -67.3 -47.54 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.686 -177.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.485 HG12 ' O ' ' B' ' 141' ' ' MET . 40.4 pt -66.32 -31.19 52.5 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.141 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . 0.535 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 91.2 mtt180 -68.97 -53.15 22.3 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 118.423 -1.311 . . . . 0.0 108.883 177.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 47.6 t -60.67 -54.96 38.92 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.403 -177.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -82.4 -41.49 19.85 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 -178.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.597 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 9.4 tt . . . . . 0 C--N 1.3 -1.572 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -166.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.433 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 9.9 ptpt . . . . . 0 N--CA 1.429 -1.485 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.57 -20.16 1.55 Allowed Glycine 0 N--CA 1.484 1.85 0 N-CA-C 117.121 1.608 . . . . 0.0 117.121 -170.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.433 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 67.2 p-90 -67.84 -16.51 64.13 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 117.462 0.631 . . . . 0.0 111.798 179.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -67.72 -9.91 47.86 Favored 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -89.47 -8.05 53.72 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.417 0.627 . . . . 0.0 109.663 176.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -100.04 3.08 43.92 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.634 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.0 p -135.27 113.82 15.97 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.997 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 -177.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 m -96.28 163.75 12.95 Favored 'General case' 0 N--CA 1.419 -2.01 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -176.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.16 -36.43 40.95 Favored 'General case' 0 C--O 1.213 -0.827 0 C-N-CA 124.325 1.05 . . . . 0.0 111.498 179.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -55.42 -44.81 76.59 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 123.257 0.623 . . . . 0.0 111.807 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.49 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.0 tm? -70.23 -51.14 33.03 Favored 'General case' 0 CA--C 1.492 -1.281 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -175.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.551 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.6 ptm180 -65.52 -40.99 93.59 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 114.505 -1.225 . . . . 0.0 113.091 -175.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.2 t -68.18 -28.33 67.18 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -66.5 -43.0 86.53 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.78 HD23 HD21 ' A' ' 68' ' ' LEU . 5.1 mp -67.38 -40.61 85.7 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.033 177.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 15' ' ' ARG . 65.2 t -57.6 -49.21 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.7 0.8 . . . . 0.0 110.095 175.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -54.49 -45.1 73.17 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.309 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.4 mttm -68.55 -38.32 80.68 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.315 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.475 ' O ' HG22 ' A' ' 26' ' ' ILE . 65.8 mt -54.07 -46.58 72.05 Favored 'General case' 0 C--O 1.214 -0.787 0 O-C-N 123.661 0.601 . . . . 0.0 109.589 174.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.664 HG11 ' HE1' ' A' ' 40' ' ' MET . 46.8 t -55.28 -53.43 35.29 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.559 0 O-C-N 124.003 0.815 . . . . 0.0 110.833 174.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -57.32 -30.69 64.99 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.499 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -82.77 -46.91 12.54 Favored 'General case' 0 C--O 1.203 -1.372 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 174.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.481 HG13 ' CE1' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -73.32 -26.57 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 121.799 0.809 . . . . 0.0 110.068 -174.819 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -131.53 91.89 33.11 Favored Pre-proline 0 N--CA 1.405 -2.721 0 C-N-CA 124.438 1.095 . . . . 0.0 108.594 176.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -63.64 93.3 0.17 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.725 1.617 . . . . 0.0 109.202 176.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.415 HG21 HD21 ' A' ' 35' ' ' LEU . 4.8 t -65.82 130.05 94.41 Favored Pre-proline 0 N--CA 1.415 -2.18 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.567 -172.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.477 ' HG2' ' OD1' ' A' ' 31' ' ' ASP . 41.8 Cg_endo -73.64 -31.63 8.46 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.588 2.192 . . . . 0.0 111.085 178.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.477 ' OD1' ' HG2' ' A' ' 30' ' ' PRO . 6.3 p-10 -144.18 155.4 58.24 Favored Pre-proline 0 N--CA 1.427 -1.622 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.429 -175.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.53 ' HA ' HD12 ' A' ' 35' ' ' LEU . 72.5 Cg_endo -75.66 -5.23 16.26 Favored 'Trans proline' 0 N--CA 1.45 -1.068 0 C-N-CA 121.77 1.647 . . . . 0.0 113.351 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -88.54 -24.68 22.84 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.542 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.93 -21.09 63.07 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 122.038 0.923 . . . . 0.0 109.831 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.53 HD12 ' HA ' ' A' ' 32' ' ' PRO . 45.2 mt -80.05 -8.44 59.37 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.24 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -134.2 21.93 3.76 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.215 0.531 . . . . 0.0 109.927 178.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.412 ' O ' ' HB3' ' A' ' 40' ' ' MET . 20.5 t70 -90.11 178.02 6.29 Favored 'General case' 0 N--CA 1.422 -1.862 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.774 ' HD2' ' N ' ' A' ' 39' ' ' ARG . 2.3 ppt_? -63.75 -28.9 70.2 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.774 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 4.5 tpm_? -70.18 -30.19 67.25 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.032 -175.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.726 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 6.7 tpp -57.72 -32.17 67.15 Favored 'General case' 0 C--O 1.201 -1.452 0 CA-C-N 114.231 -1.35 . . . . 0.0 112.086 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -61.42 -29.83 70.18 Favored 'General case' 0 C--O 1.18 -2.594 0 C-N-CA 118.111 -1.436 . . . . 0.0 110.918 -179.445 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.43 HD22 HD12 ' A' ' 43' ' ' LEU . 2.6 t30 -75.48 -46.66 31.14 Favored 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 124.024 0.828 . . . . 0.0 109.088 176.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 39' ' ' ARG . 5.2 mp -51.63 -56.94 10.72 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 114.299 -1.319 . . . . 0.0 109.894 179.275 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.726 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -73.29 -28.2 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.59 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.517 -177.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -61.53 -43.24 99.22 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.546 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.9 t80 -65.81 -47.08 76.26 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.61 174.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.44 -40.91 88.32 Favored 'General case' 0 C--O 1.2 -1.51 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.829 -176.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.7 -43.07 80.94 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.612 0.765 . . . . 0.0 111.997 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.546 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 57.0 pttt -67.04 -40.25 87.12 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.399 0.619 . . . . 0.0 109.708 -178.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.448 HG21 ' CE2' ' A' ' 46' ' ' TYR . 45.7 t -71.53 -47.26 59.23 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.668 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -57.73 -45.65 85.52 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.91 -44.39 94.45 Favored Glycine 0 N--CA 1.436 -1.349 0 O-C-N 124.236 0.96 . . . . 0.0 111.768 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -58.72 -54.19 49.86 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.478 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -65.26 -35.21 80.31 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 178.768 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -62.91 -50.88 69.1 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.644 0.735 . . . . 0.0 109.34 177.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.78 -21.75 61.68 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.163 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.7 t -85.28 -42.8 14.3 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -178.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.05 163.52 14.63 Favored 'General case' 0 C--O 1.244 0.797 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -109.05 2.82 21.46 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.583 -178.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.419 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 48.7 m -161.44 154.29 20.69 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 176.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.58 -34.53 74.28 Favored 'General case' 0 C--O 1.196 -1.757 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.184 -178.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.419 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 4.9 p-10 -65.12 -35.83 82.36 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -66.82 -47.84 70.78 Favored 'General case' 0 N--CA 1.455 -0.175 0 O-C-N 123.487 0.492 . . . . 0.0 110.564 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -45.1 89.94 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.252 -177.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -60.65 -46.01 91.92 Favored 'General case' 0 C--O 1.19 -2.063 0 O-C-N 123.978 0.799 . . . . 0.0 109.719 176.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.555 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 28.7 t-80 -60.05 -55.05 38.7 Favored 'General case' 0 C--O 1.208 -1.104 0 O-C-N 123.194 0.309 . . . . 0.0 111.581 -178.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.455 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.1 pp -65.74 -32.55 74.16 Favored 'General case' 0 C--O 1.262 1.746 0 CA-C-O 120.965 0.412 . . . . 0.0 111.47 -175.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.78 HD21 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -75.09 -35.83 61.75 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.362 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.633 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.11 -34.84 78.47 Favored 'General case' 0 C--O 1.203 -1.347 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.736 176.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.555 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 17.2 mt-10 -69.43 -42.53 74.86 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.467 178.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.9 -38.82 83.47 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.393 -0.923 . . . . 0.0 110.891 179.231 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.633 HG22 ' HA ' ' A' ' 69' ' ' ALA . 5.9 tt -66.2 -48.37 81.48 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.853 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.548 177.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.454 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 8.3 t80 -51.71 -51.39 56.4 Favored 'General case' 0 C--O 1.269 2.116 0 C-N-CA 124.949 1.3 . . . . 0.0 111.837 178.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.8 ptpt -65.03 -38.8 92.06 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.884 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.487 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -64.42 -37.06 79.03 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.654 0 O-C-N 123.557 0.536 . . . . 0.0 111.124 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.663 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.2 mm-40 -59.65 -55.38 35.17 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 122.085 0.945 . . . . 0.0 109.454 178.479 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 1.2 ptpm? -70.19 -27.66 64.68 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.572 178.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.528 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 6.3 tp10 -63.67 -45.84 88.28 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 176.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.7 pp -64.79 -44.83 88.7 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.874 -177.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.464 ' N ' HD12 ' A' ' 79' ' ' LEU . 7.1 pt-20 -68.67 -44.63 73.65 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 119.364 -0.934 . . . . 0.0 112.65 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.6 -40.06 95.73 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.421 -0.511 . . . . 0.0 110.813 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.66 -29.83 62.56 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.403 -178.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.035 -179.519 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.612 HD21 ' HB3' ' A' ' 79' ' ' LEU . 47.7 tp . . . . . 0 C--O 1.222 -0.368 0 CA-C-O 121.172 0.511 . . . . 0.0 110.128 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 46.4 tp -69.58 -37.72 77.09 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 18.2 m -63.56 -41.35 98.41 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 14.3 m -63.94 -46.67 83.69 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.417 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 16.2 t70 . . . . . 0 C--N 1.315 -0.919 0 C-N-CA 125.117 1.367 . . . . 0.0 111.135 -177.988 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.587 ' HB2' ' HB ' ' B' ' 145' ' ' ILE . 64.0 mtm . . . . . 0 N--CA 1.435 -1.202 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 29.4 -86.54 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 127.684 2.394 . . . . 0.0 114.432 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.53 -46.95 62.64 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.966 -172.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 47.3 mm -64.42 -47.97 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-N 114.161 -1.381 . . . . 0.0 109.167 -177.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.587 ' HB ' ' HB2' ' B' ' 141' ' ' MET . 15.6 tt -70.01 -31.57 48.26 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.403 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.616 -176.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 27.6 ttm-85 -64.73 -60.6 2.92 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 19.3 p -66.78 -44.04 82.37 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -174.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -80.57 -38.83 28.79 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.478 ' HA ' ' HB1' ' A' ' 69' ' ' ALA 0.267 9.1 tt . . . . . 0 C--N 1.315 -0.892 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -173.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.421 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 42.3 mttp . . . . . 0 N--CA 1.42 -1.975 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.461 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -67.03 -3.92 25.56 Favored Glycine 0 C--N 1.31 -0.889 0 CA-C-N 115.838 -0.619 . . . . 0.0 114.263 -174.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.421 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 61.1 p-90 -78.76 -11.84 60.0 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 122.275 -0.544 . . . . 0.0 111.108 177.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -59.07 -26.56 64.73 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-O 121.267 0.556 . . . . 0.0 111.233 -178.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 12.9 pt-20 -81.89 -4.11 55.77 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -176.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -104.52 2.78 31.24 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 120.973 0.416 . . . . 0.0 111.555 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.755 HG22 ' HB3' ' A' ' 61' ' ' ARG . 1.5 t -110.5 110.54 32.55 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.459 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.497 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER -68.9 151.55 46.42 Favored 'General case' 0 N--CA 1.412 -2.373 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -179.15 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -55.03 -41.65 71.62 Favored 'General case' 0 N--CA 1.426 -1.627 0 O-C-N 124.672 1.232 . . . . 0.0 108.796 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.487 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 10.9 m-20 -67.45 -30.52 70.28 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-O 118.866 -0.587 . . . . 0.0 112.534 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.531 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.68 -54.65 7.62 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' A' ' 11' ' ' THR . 1.6 ptm180 -55.14 -48.2 74.02 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 177.027 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.417 ' HA ' ' HB ' ' A' ' 19' ' ' VAL . 40.0 m -72.61 -21.13 61.17 Favored 'General case' 0 N--CA 1.426 -1.664 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.487 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 10.5 t60 -67.89 -42.43 81.22 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 174.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.71 HD23 HD21 ' A' ' 68' ' ' LEU . 3.9 mp -69.84 -40.08 76.05 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.794 178.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.2 t -55.8 -49.72 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 C-N-CA 123.559 0.744 . . . . 0.0 109.942 172.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -53.15 -50.38 64.66 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.264 1.026 . . . . 0.0 110.122 178.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -66.73 -38.14 86.08 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.046 179.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.493 ' O ' HG22 ' A' ' 26' ' ' ILE . 3.2 mt -51.02 -50.79 57.87 Favored 'General case' 0 CA--C 1.495 -1.152 0 O-C-N 123.924 0.765 . . . . 0.0 109.61 174.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.626 HG11 ' HE1' ' A' ' 40' ' ' MET . 57.8 t -55.56 -52.78 43.56 Favored 'Isoleucine or valine' 0 C--O 1.172 -2.999 0 O-C-N 124.336 1.023 . . . . 0.0 109.771 175.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -54.09 -33.29 57.21 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -175.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.549 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -82.01 -46.23 14.24 Favored 'General case' 0 C--O 1.207 -1.175 0 CA-C-O 121.505 0.669 . . . . 0.0 111.597 175.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.579 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -78.55 -23.69 13.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 CA-C-O 122.065 0.936 . . . . 0.0 110.84 -174.082 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.579 ' CD2' HG23 ' A' ' 26' ' ' ILE . 66.1 m-85 -135.31 95.26 14.86 Favored Pre-proline 0 C--N 1.279 -2.47 0 C-N-CA 125.057 1.343 . . . . 0.0 107.491 178.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -60.53 95.29 0.11 Allowed 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.287 1.992 . . . . 0.0 112.47 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.448 HG21 HD21 ' A' ' 35' ' ' LEU . 10.0 t -75.27 124.62 89.29 Favored Pre-proline 0 N--CA 1.424 -1.74 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.058 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.39 -29.36 13.85 Favored 'Trans proline' 0 C--O 1.245 0.869 0 C-N-CA 122.402 2.068 . . . . 0.0 111.752 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -141.54 151.72 61.39 Favored Pre-proline 0 CA--C 1.486 -1.496 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -176.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.496 ' HA ' HD12 ' A' ' 35' ' ' LEU . 38.1 Cg_endo -71.67 -7.35 21.0 Favored 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 121.587 1.525 . . . . 0.0 111.611 175.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.9 -12.9 43.39 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-O 121.318 0.58 . . . . 0.0 110.69 177.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.53 -6.09 54.48 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 122.159 0.98 . . . . 0.0 108.722 175.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.566 ' O ' ' HG2' ' A' ' 40' ' ' MET . 27.6 mt -91.75 6.53 45.59 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.797 -179.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -133.07 21.91 4.12 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.619 ' OD1' ' HD3' ' A' ' 38' ' ' ARG . 13.9 t70 -85.16 170.26 13.06 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.695 -1.593 . . . . 0.0 108.449 -178.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.619 ' HD3' ' OD1' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.63 -24.74 61.93 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.939 0.876 . . . . 0.0 110.567 178.747 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.618 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 40.3 ttp180 -75.02 -21.2 59.23 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.818 -1.083 . . . . 0.0 109.109 178.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.768 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.2 tpp -60.67 -34.26 74.05 Favored 'General case' 0 C--O 1.207 -1.155 0 CA-C-N 115.124 -0.943 . . . . 0.0 112.413 -179.189 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.36 -31.24 71.86 Favored 'General case' 0 C--O 1.197 -1.689 0 C-N-CA 117.748 -1.581 . . . . 0.0 110.711 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.45 HD22 HD23 ' A' ' 43' ' ' LEU . 5.5 t30 -74.31 -46.49 40.7 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 121.393 0.616 . . . . 0.0 109.712 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.3 mt -59.78 -49.63 76.97 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.578 -179.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.768 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.6 p -73.3 -27.68 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.577 -178.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.31 -47.06 86.83 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 177.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.538 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 16.6 t80 -62.91 -45.69 91.34 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.068 174.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.66 94.12 Favored 'General case' 0 C--O 1.203 -1.352 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.216 -177.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -62.85 -44.79 95.19 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 123.29 0.636 . . . . 0.0 111.327 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.538 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 53.9 pttt -66.64 -36.49 82.7 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.645 0.736 . . . . 0.0 110.702 -177.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.509 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 69.4 t -75.23 -42.68 44.18 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.668 178.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.77 -43.3 90.33 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.23 -43.44 98.46 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.502 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.406 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 21.3 t70 -53.93 -51.97 62.08 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.257 0.623 . . . . 0.0 111.373 178.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.474 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -74.28 -27.6 60.81 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 179.66 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -63.86 -49.86 71.08 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 176.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -73.18 -22.63 60.44 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.979 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.3 t -81.37 -13.6 58.14 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.136 178.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.26 169.58 9.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.532 0.682 . . . . 0.0 112.487 -178.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -119.13 6.38 11.27 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.468 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.9 m -164.94 147.37 8.2 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.755 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -55.87 -40.39 72.87 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 175.343 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -56.17 -46.13 79.44 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.229 0.537 . . . . 0.0 110.139 178.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.65 -46.42 82.59 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.153 178.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -44.06 92.95 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 123.366 0.416 . . . . 0.0 109.994 -177.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -59.83 -47.58 85.15 Favored 'General case' 0 C--O 1.201 -1.45 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.631 175.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -62.31 -48.42 79.95 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -177.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.474 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.9 pp -71.97 -30.69 65.53 Favored 'General case' 0 C--O 1.258 1.507 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.273 -175.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.71 HD21 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -75.77 -33.6 60.2 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.554 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -62.07 -40.12 94.72 Favored 'General case' 0 C--O 1.198 -1.607 0 CA-C-N 115.03 -0.986 . . . . 0.0 108.781 176.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.87 -46.46 87.76 Favored 'General case' 0 C--O 1.259 1.58 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.932 177.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.77 -40.82 88.35 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.168 179.646 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 7.8 tt -67.08 -44.76 87.93 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.228 -178.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -52.64 -49.5 65.03 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 125.869 1.668 . . . . 0.0 111.215 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -69.18 -33.26 73.1 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.442 -179.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.549 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.5 mp -66.28 -39.28 83.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 116.772 -0.194 . . . . 0.0 110.707 175.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.592 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 22.5 mm-40 -58.62 -48.54 80.66 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.306 0.575 . . . . 0.0 109.491 178.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.735 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS 0.252 0.0 OUTLIER -69.5 -33.35 72.72 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 175.917 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -59.37 -45.92 90.1 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 176.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.4 pp -67.36 -39.71 85.73 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.459 -179.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.581 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 14.6 pt-20 -63.74 -45.16 91.16 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.04 0.382 . . . . 0.0 110.457 -178.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.57 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.7 pt-20 -76.01 -37.8 58.02 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -33.34 72.92 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.034 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 28.9 tpt180 . . . . . 0 N--CA 1.467 0.421 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.312 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.566 HD21 ' HB3' ' A' ' 79' ' ' LEU . 48.8 tp . . . . . 0 C--O 1.216 -0.67 0 CA-C-O 120.765 0.317 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.16 -42.34 66.02 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 175.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 30.7 m -68.83 -35.59 77.16 Favored 'General case' 0 CA--C 1.553 1.059 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.216 178.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 29.8 m -74.48 -26.64 60.14 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-O 121.36 0.6 . . . . 0.0 110.876 177.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 15.1 t70 . . . . . 0 C--N 1.321 -0.634 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . 0.559 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 53.4 ttp . . . . . 0 C--O 1.206 -1.203 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -46.51 -58.09 4.1 Favored 'General case' 0 CA--C 1.568 1.646 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 -171.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 10.0 m -65.43 -39.57 92.26 Favored 'General case' 0 C--O 1.264 1.861 0 CA-C-O 121.922 0.868 . . . . 0.0 110.387 -176.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 47.1 mm -67.45 -44.87 86.53 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.133 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.365 -179.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.559 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 18.3 tt -67.82 -31.13 50.88 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-O 120.832 0.349 . . . . 0.0 111.494 -176.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -65.31 0.71 Allowed 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.062 171.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.7 p -61.1 -43.11 99.38 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -174.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -81.32 -46.69 14.35 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.554 ' HA ' ' HB1' ' A' ' 69' ' ' ALA 0.279 8.2 tt . . . . . 0 C--N 1.317 -0.829 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -169.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.465 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 82.9 mttt . . . . . 0 N--CA 1.428 -1.557 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.58 -22.38 39.01 Favored Glycine 0 N--CA 1.464 0.56 0 O-C-N 123.904 0.752 . . . . 0.0 114.892 -173.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.465 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 68.9 p-90 -74.97 -5.02 41.66 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 122.216 -0.579 . . . . 0.0 112.173 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -61.04 -26.59 67.73 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 117.98 0.354 . . . . 0.0 110.941 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -78.13 -7.05 56.52 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.595 0.712 . . . . 0.0 110.368 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 -102.35 3.14 37.65 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.817 -177.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.406 HG23 HD12 ' A' ' 14' ' ' LEU . 6.0 p -136.52 109.55 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.843 0 CA-C-O 122.157 0.98 . . . . 0.0 108.839 -179.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.5 m -86.37 155.76 20.47 Favored 'General case' 0 C--N 1.286 -2.162 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.376 -175.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.71 -39.47 51.61 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.409 1.084 . . . . 0.0 110.928 177.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -57.43 -41.11 79.8 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 178.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.542 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.1 tm? -69.02 -52.31 30.0 Favored 'General case' 0 CA--C 1.485 -1.543 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -175.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.574 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.8 ptm180 -64.5 -44.67 90.22 Favored 'General case' 0 N--CA 1.413 -2.299 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.985 -176.156 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 t -64.21 -29.93 71.01 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.946 0.403 . . . . 0.0 110.038 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -66.18 -45.57 80.39 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.736 HD23 HD21 ' A' ' 68' ' ' LEU . 4.9 mp -66.24 -39.42 89.52 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.739 177.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 15' ' ' ARG . 62.2 t -58.15 -50.18 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 124.329 1.052 . . . . 0.0 110.361 175.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -54.8 -46.56 74.51 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.483 177.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -65.94 -38.83 89.65 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.848 177.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.513 ' O ' HG22 ' A' ' 26' ' ' ILE . 20.7 mt -52.09 -49.31 63.84 Favored 'General case' 0 CA--C 1.498 -1.033 0 O-C-N 123.859 0.724 . . . . 0.0 110.023 174.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.458 HG13 ' HB3' ' A' ' 43' ' ' LEU . 71.2 t -56.62 -52.36 54.64 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.677 0 O-C-N 124.139 0.899 . . . . 0.0 109.825 175.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -53.58 -34.5 58.58 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -178.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.5 -45.9 15.3 Favored 'General case' 0 C--O 1.2 -1.539 0 CA-C-O 121.152 0.501 . . . . 0.0 111.917 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.533 HG13 ' CZ ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -75.31 -32.94 26.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-O 121.365 0.602 . . . . 0.0 110.679 -175.05 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.501 ' CD2' HG23 ' A' ' 26' ' ' ILE . 56.4 m-85 -128.56 91.57 43.22 Favored Pre-proline 0 C--N 1.283 -2.284 0 C-N-CA 124.801 1.24 . . . . 0.0 108.256 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.21 96.55 0.34 Allowed 'Trans proline' 0 N--CA 1.447 -1.224 0 C-N-CA 121.51 1.473 . . . . 0.0 110.062 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.8 t -52.64 123.56 31.1 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.879 -176.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.88 -16.88 29.28 Favored 'Trans proline' 0 C--O 1.237 0.451 0 C-N-CA 122.389 2.059 . . . . 0.0 112.27 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -163.39 148.54 9.26 Favored Pre-proline 0 N--CA 1.446 -0.638 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -174.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.43 ' O ' HD12 ' A' ' 35' ' ' LEU . 4.8 Cg_endo -52.57 -27.59 33.3 Favored 'Trans proline' 0 CA--C 1.559 1.749 0 C-N-CA 123.34 2.694 . . . . 0.0 113.172 173.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.63 -11.61 57.05 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 121.133 -0.98 . . . . 0.0 111.813 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.44 -42.1 30.93 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.085 0.469 . . . . 0.0 110.692 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.43 HD12 ' O ' ' A' ' 32' ' ' PRO 0.326 0.3 OUTLIER -75.84 8.51 3.02 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 178.039 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -133.06 17.97 4.11 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.408 0.623 . . . . 0.0 110.263 174.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.574 ' O ' ' HB3' ' A' ' 40' ' ' MET . 36.6 t70 -93.21 -178.38 4.75 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.721 -178.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.536 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.91 -22.45 62.25 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.916 -0.49 . . . . 0.0 110.46 179.246 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.571 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 42.3 ttm180 -73.27 -21.9 60.5 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.516 0.674 . . . . 0.0 109.716 176.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.657 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.4 tpp -61.55 -34.53 75.72 Favored 'General case' 0 C--O 1.197 -1.704 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.869 177.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.615 ' HA ' HG12 ' A' ' 44' ' ' VAL . 12.9 pt-20 -66.97 -24.86 66.1 Favored 'General case' 0 C--O 1.2 -1.531 0 C-N-CA 118.33 -1.348 . . . . 0.0 110.844 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.443 HD22 HD23 ' A' ' 43' ' ' LEU . 4.7 t30 -74.28 -44.58 52.18 Favored 'General case' 0 C--O 1.249 1.063 0 CA-C-O 121.485 0.659 . . . . 0.0 109.548 174.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.4 mt -63.08 -49.12 75.75 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.504 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.657 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 2.6 p -70.58 -27.89 32.7 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.337 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.685 -178.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.31 96.28 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 176.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.572 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.1 t80 -60.79 -47.76 84.85 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 173.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.81 -43.41 94.53 Favored 'General case' 0 C--O 1.197 -1.709 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.999 -176.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -64.0 -42.39 97.17 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 123.525 0.73 . . . . 0.0 112.06 177.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.4 pttp -68.01 -37.09 81.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.489 0.661 . . . . 0.0 110.056 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.486 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 52.9 t -73.06 -49.41 38.93 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.576 178.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 13.8 tm-20 -56.62 -46.07 81.16 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 124.112 0.965 . . . . 0.0 109.202 178.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.493 ' O ' ' HG2' ' A' ' 56' ' ' GLU . . . -58.01 -48.19 84.24 Favored Glycine 0 N--CA 1.432 -1.609 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.88 178.307 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -56.71 -51.16 69.87 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.118 0.485 . . . . 0.0 111.781 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.512 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -67.99 -29.62 68.68 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 179.139 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.421 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 65.6 t80 -62.75 -51.52 66.83 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 176.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 52' ' ' GLY . 5.9 mm-40 -71.95 -24.48 61.62 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.691 -177.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 t -79.55 -22.05 44.33 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.312 0.577 . . . . 0.0 110.183 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -93.15 162.81 13.87 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 121.157 0.504 . . . . 0.0 111.171 -177.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -118.51 19.01 13.45 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.647 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.5 p -167.21 157.2 10.98 Favored 'General case' 0 CA--C 1.488 -1.441 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 171.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HA ' ' HD2' ' A' ' 64' ' ' TYR . 0.1 OUTLIER -72.29 -26.1 61.84 Favored 'General case' 0 C--N 1.308 -1.196 0 C-N-CA 119.241 -0.984 . . . . 0.0 111.432 179.135 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -65.53 -47.37 76.15 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.87 -47.31 86.27 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.865 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.416 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -65.19 -46.63 79.97 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.963 -176.892 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 2.4 t80 -60.99 -43.43 98.88 Favored 'General case' 0 C--O 1.203 -1.351 0 O-C-N 123.8 0.687 . . . . 0.0 110.301 178.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.436 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 31.8 t-80 -62.88 -54.66 35.24 Favored 'General case' 0 C--O 1.214 -0.789 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.1 pp -65.39 -33.64 76.43 Favored 'General case' 0 C--O 1.272 2.286 0 CA-C-O 121.413 0.625 . . . . 0.0 111.634 -175.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.736 HD21 HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -73.79 -35.29 64.9 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.236 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.556 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.78 -34.49 78.02 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.159 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 17.4 mt-10 -68.44 -46.76 69.0 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 120.134 -0.626 . . . . 0.0 110.055 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -64.73 -36.83 85.55 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 119.501 -0.88 . . . . 0.0 111.512 -179.038 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.642 HD13 HD11 ' B' ' 149' ' ' LEU . 8.9 tt -69.31 -47.07 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.576 179.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.483 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 23.0 t80 -51.68 -49.94 61.4 Favored 'General case' 0 C--O 1.256 1.427 0 C-N-CA 125.889 1.676 . . . . 0.0 111.063 178.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -67.35 -34.64 77.74 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.679 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.557 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.3 mp -68.79 -34.83 66.68 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 CA-C-O 120.603 0.239 . . . . 0.0 111.086 177.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 72' ' ' ILE . 22.1 mm-40 -62.06 -49.52 75.67 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.505 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS . 0.5 OUTLIER -71.92 -31.04 65.97 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 119.656 -0.818 . . . . 0.0 113.088 177.491 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -57.92 -50.35 73.65 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 175.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -64.93 -36.95 86.04 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.379 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 77' ' ' LYS . 3.2 mm-40 -61.01 -53.54 56.01 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.131 0.572 . . . . 0.0 111.612 177.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -69.5 -39.8 77.4 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.854 -177.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.61 -34.23 77.76 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -178.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 . . . . . 0 N--CA 1.446 -0.627 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.904 -178.902 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.49 HD21 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.207 -1.151 0 N-CA-C 110.603 -0.147 . . . . 0.0 110.603 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.3 tp -65.37 -36.93 85.48 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 176.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 62.4 m -64.36 -46.39 83.6 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 14.7 m -67.03 -34.69 78.25 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.974 178.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.8 t70 . . . . . 0 C--N 1.319 -0.74 0 C-N-CA 123.901 0.881 . . . . 0.0 108.85 179.268 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 17.8 ptm . . . . . 0 C--O 1.181 -2.544 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.483 ' CD ' ' H ' ' B' ' 142' ' ' GLU . 1.8 mp0 -26.92 -61.1 0.09 Allowed 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -167.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 28.5 m -71.27 -38.19 71.88 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.834 -0.541 . . . . 0.0 111.671 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 48.0 mm -68.68 -47.56 75.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.504 ' HA ' ' OH ' ' A' ' 65' ' ' TYR . 7.9 tp -61.75 -39.07 82.01 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.307 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 41.3 ttt180 -65.35 -49.5 69.11 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 118.573 -1.251 . . . . 0.0 110.82 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 28.9 m -66.08 -44.84 83.28 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.0 -40.28 39.57 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 121.076 -0.249 . . . . 0.0 111.586 -175.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.642 HD11 HD13 ' A' ' 72' ' ' ILE . 2.8 tm? . . . . . 0 C--N 1.313 -0.987 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.358 -173.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.615 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.2 ptpt . . . . . 0 N--CA 1.421 -1.883 0 CA-C-O 121.821 0.819 . . . . 0.0 110.175 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.02 -8.4 8.33 Favored Glycine 0 C--O 1.243 0.669 0 CA-C-N 114.29 -1.323 . . . . 0.0 115.471 -173.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.615 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 59.7 p-90 -62.48 -16.25 54.4 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 117.129 0.465 . . . . 0.0 111.405 177.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -59.97 -11.84 6.6 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 178.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -89.82 -8.31 52.35 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.034 0.445 . . . . 0.0 110.336 178.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -107.6 13.61 26.51 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.628 0.728 . . . . 0.0 111.042 -174.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.3 p -134.14 110.52 13.86 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.205 0 CA-C-O 122.156 0.979 . . . . 0.0 108.598 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.9 m -81.16 154.35 26.76 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.197 -173.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.425 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -59.49 -34.84 73.08 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.415 178.458 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.98 -39.21 81.05 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.941 176.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.536 ' O ' HD13 ' A' ' 18' ' ' LEU . 2.9 tm? -69.67 -52.43 25.82 Favored 'General case' 0 CA--C 1.493 -1.247 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 -177.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.568 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.2 ptm180 -65.1 -44.17 89.7 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.882 -175.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.0 t -66.52 -27.13 67.52 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 24.9 t60 -67.62 -46.31 72.87 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.705 HD23 HD21 ' A' ' 68' ' ' LEU . 5.1 mp -63.89 -38.99 93.13 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.698 177.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.6 t -58.19 -48.38 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 123.644 0.778 . . . . 0.0 109.972 174.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.537 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 18.5 t-80 -55.37 -45.85 76.5 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.445 0.698 . . . . 0.0 110.351 177.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.581 ' HD3' HD22 ' B' ' 149' ' ' LEU . 34.1 mttp -65.67 -38.65 89.87 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.87 178.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.99 -44.65 82.91 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.537 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 25.1 t -53.73 -49.36 57.91 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.906 0 C-N-CA 124.055 0.942 . . . . 0.0 110.931 172.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -69.61 -25.86 64.16 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.029 -0.668 . . . . 0.0 112.58 -176.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.421 ' O ' HD11 ' B' ' 114' ' ' LEU . . . -78.83 -42.18 28.3 Favored 'General case' 0 C--O 1.196 -1.732 0 C-N-CA 120.971 -0.292 . . . . 0.0 110.747 174.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.496 ' HA ' HD21 ' B' ' 114' ' ' LEU . 3.9 tt -70.68 -38.82 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 119.902 -0.719 . . . . 0.0 111.194 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.421 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 84.4 t80 -125.52 99.09 33.61 Favored Pre-proline 0 N--CA 1.415 -2.192 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -175.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 19.5 Cg_endo -60.43 97.84 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 121.735 1.623 . . . . 0.0 108.815 170.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.0 t -75.8 136.68 70.24 Favored Pre-proline 0 N--CA 1.426 -1.664 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.624 -176.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.48 -21.3 11.68 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 122.498 2.132 . . . . 0.0 111.677 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -158.31 141.93 11.11 Favored Pre-proline 0 CA--C 1.496 -1.133 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -176.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -55.49 -20.04 25.16 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.913 2.409 . . . . 0.0 114.61 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.9 -10.04 59.41 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 121.171 -0.956 . . . . 0.0 112.03 179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -6.56 55.24 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.179 0.99 . . . . 0.0 108.828 174.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.506 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.4 mt -90.94 5.65 47.85 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.22 -179.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.13 26.96 4.21 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 176.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.57 ' O ' ' HB3' ' A' ' 40' ' ' MET . 22.7 t70 -92.29 173.08 8.0 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.627 -1.169 . . . . 0.0 109.424 -177.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.544 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.26 -25.94 62.68 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.209 0.528 . . . . 0.0 110.324 177.811 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.489 ' O ' ' HB3' ' A' ' 42' ' ' ASN . 33.7 ttm180 -72.19 -27.43 62.55 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-O 121.589 0.709 . . . . 0.0 109.951 176.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.639 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 4.8 tpp -57.25 -37.41 72.26 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.242 178.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -61.44 -29.08 69.72 Favored 'General case' 0 C--O 1.202 -1.407 0 C-N-CA 119.023 -1.071 . . . . 0.0 110.245 -179.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.489 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.3 t30 -69.68 -48.63 59.03 Favored 'General case' 0 C--O 1.253 1.25 0 C-N-CA 122.849 0.46 . . . . 0.0 109.993 175.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.446 HD22 ' O ' ' A' ' 39' ' ' ARG . 2.7 mm? -61.97 -51.61 67.37 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.274 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.639 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -67.77 -29.21 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.832 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.082 -176.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.96 92.27 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.097 0.475 . . . . 0.0 109.865 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.57 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 1.7 t80 -62.38 -46.86 86.72 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.622 174.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.81 91.54 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.092 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -64.75 -44.28 90.59 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 123.742 0.817 . . . . 0.0 112.487 177.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.7 pttp -64.77 -39.94 94.44 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-O 121.489 0.661 . . . . 0.0 109.532 -178.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.1 t -67.68 -53.24 32.84 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.978 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -55.4 -48.33 74.52 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 124.036 0.934 . . . . 0.0 110.02 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.37 -37.79 94.65 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.486 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -64.52 -47.76 77.64 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 121.398 0.618 . . . . 0.0 110.718 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.471 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -70.28 -29.49 66.27 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 121.817 -0.552 . . . . 0.0 112.11 176.688 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -62.9 -54.7 34.54 Favored 'General case' 0 C--O 1.193 -1.873 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -68.99 -27.2 65.48 Favored 'General case' 0 C--N 1.307 -1.252 0 O-C-N 122.027 -0.421 . . . . 0.0 111.563 -177.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.2 t -74.34 -32.97 62.99 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 123.504 0.721 . . . . 0.0 112.455 -178.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.03 159.92 30.33 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -174.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -98.93 -1.98 38.65 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.171 178.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.434 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 66.4 p -168.17 158.0 9.84 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.529 174.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.486 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -62.56 -35.62 80.05 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -179.318 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -67.57 -33.67 75.5 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -70.75 -44.76 66.09 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.683 175.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -45.8 89.14 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.481 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 1.3 t80 -60.74 -46.59 89.83 Favored 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.031 176.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -59.18 -52.04 67.42 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.471 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -67.88 -37.63 82.02 Favored 'General case' 0 C--O 1.267 2.016 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.944 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.705 HD21 HD23 ' A' ' 18' ' ' LEU . 1.5 pp -68.9 -36.62 78.26 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.529 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.02 -41.21 97.52 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.607 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -62.77 -46.42 88.11 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.542 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -38.07 69.94 Favored 'General case' 0 N--CA 1.438 -1.047 0 C-N-CA 118.935 -1.106 . . . . 0.0 112.14 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.541 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 4.2 tt -65.26 -45.83 92.46 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.15 178.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.489 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 17.8 t80 -53.29 -53.34 52.37 Favored 'General case' 0 C--O 1.272 2.259 0 C-N-CA 125.37 1.468 . . . . 0.0 111.409 178.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.3 ptpt -63.72 -34.22 77.39 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.756 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.78 -40.78 84.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 O-C-N 123.5 0.5 . . . . 0.0 111.913 177.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.601 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.4 mm-40 -57.96 -53.59 56.57 Favored 'General case' 0 C--O 1.253 1.239 0 CA-C-O 121.967 0.889 . . . . 0.0 109.554 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.545 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 12.2 ptpt -70.3 -32.53 70.35 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 118.977 -1.089 . . . . 0.0 112.888 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.491 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 18.6 tp10 -62.34 -46.35 89.07 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.2 pp -63.45 -43.27 97.86 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.042 -177.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.495 ' N ' HD12 ' A' ' 79' ' ' LEU . 7.2 pt-20 -69.38 -43.82 72.74 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 118.809 -1.156 . . . . 0.0 112.156 -178.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 13.3 pt-20 -69.98 -32.27 70.4 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 120.325 -0.55 . . . . 0.0 112.066 -178.008 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.494 ' C ' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -72.93 -35.5 67.02 Favored 'General case' 0 C--O 1.215 -0.761 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.221 177.647 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.416 ' HD3' ' OD2' ' B' ' 118' ' ' ASP . 18.5 tpt180 . . . . . 0 C--O 1.234 0.276 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.149 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 26' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.191 -2.007 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 58.9 tp -62.37 -33.35 74.57 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 121.211 0.529 . . . . 0.0 110.135 175.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 40.9 m -72.15 -43.69 64.25 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.477 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 13.5 p -73.52 -26.89 61.08 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-O 121.442 0.639 . . . . 0.0 110.909 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.416 ' OD2' ' HD3' ' A' ' 83' ' ' ARG . 5.4 t70 . . . . . 0 C--N 1.312 -1.06 0 C-N-CA 124.456 1.102 . . . . 0.0 109.695 173.095 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 21.5 ptp . . . . . 0 N--CA 1.484 1.248 0 N-CA-C 117.027 2.232 . . . . 0.0 117.027 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -21.92 -64.77 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 118.717 2.858 . . . . 0.0 118.717 -165.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 19.4 p -67.65 -44.69 77.3 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.172 0.511 . . . . 0.0 111.721 -171.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 57.2 mt -66.55 -46.6 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.946 -178.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . 0.485 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 18.2 tt -67.65 -33.36 61.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -69.64 -52.45 25.77 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.642 176.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.3 m -64.85 -41.81 95.39 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -176.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -81.08 -39.89 24.99 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -177.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.581 HD22 ' HD3' ' A' ' 21' ' ' LYS . 8.3 tt . . . . . 0 C--N 1.315 -0.927 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 -169.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.458 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 79.3 mttt . . . . . 0 N--CA 1.428 -1.557 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.31 -20.55 10.43 Favored Glycine 0 N--CA 1.466 0.648 0 N-CA-C 115.69 1.036 . . . . 0.0 115.69 -174.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.458 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 67.2 p-90 -70.39 -12.57 61.67 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 122.287 -0.537 . . . . 0.0 111.986 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -58.96 -21.2 58.05 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-O 120.92 0.391 . . . . 0.0 111.955 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -82.38 -13.48 56.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.477 0.656 . . . . 0.0 110.316 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -94.24 2.26 55.91 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.218 -176.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.457 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.9 p -129.12 110.86 21.44 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 CA-C-O 121.416 0.627 . . . . 0.0 110.07 -177.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 m -88.72 157.19 18.6 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.928 -176.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.59 -37.32 62.85 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.841 0.856 . . . . 0.0 111.267 178.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.07 -35.36 80.01 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.569 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -70.49 -52.0 25.03 Favored 'General case' 0 CA--C 1.488 -1.438 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -176.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.509 ' O ' HG23 ' A' ' 19' ' ' VAL . 3.7 ptm180 -63.32 -44.62 94.43 Favored 'General case' 0 N--CA 1.42 -1.96 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.996 -178.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 t -61.95 -31.49 71.84 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.785 0.326 . . . . 0.0 110.445 178.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -66.66 -45.47 78.84 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.822 HD23 HD21 ' A' ' 68' ' ' LEU . 7.0 mp -67.32 -40.84 86.01 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.221 178.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 15' ' ' ARG . 54.6 t -56.47 -49.96 74.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 124.306 1.043 . . . . 0.0 109.828 175.012 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -58.12 -44.12 87.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.095 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -66.6 -40.92 89.1 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.931 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.524 ' O ' HG22 ' A' ' 26' ' ' ILE . 11.7 mt -50.83 -51.12 54.19 Favored 'General case' 0 CA--C 1.5 -0.959 0 O-C-N 124.211 0.944 . . . . 0.0 109.057 173.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.466 HG11 ' CE ' ' A' ' 40' ' ' MET . 79.2 t -55.23 -52.89 40.66 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.799 0 O-C-N 124.484 1.115 . . . . 0.0 111.05 175.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -52.46 -35.83 53.38 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB2' HE21 ' A' ' 76' ' ' GLN . . . -81.89 -46.48 14.03 Favored 'General case' 0 C--O 1.2 -1.518 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 176.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.625 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.5 -24.76 14.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-O 122.218 1.009 . . . . 0.0 110.499 -174.111 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.625 ' CD2' HG23 ' A' ' 26' ' ' ILE . 75.1 m-85 -131.01 86.52 51.53 Favored Pre-proline 0 C--N 1.271 -2.828 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.497 178.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -61.22 104.88 0.31 Allowed 'Trans proline' 0 N--CA 1.441 -1.57 0 N-CA-C 108.636 -1.332 . . . . 0.0 108.636 175.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.9 t -72.68 143.03 84.29 Favored Pre-proline 0 N--CA 1.422 -1.865 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.751 -173.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -77.94 -29.51 4.25 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.226 2.618 . . . . 0.0 111.073 175.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -137.72 135.92 19.54 Favored Pre-proline 0 CA--C 1.493 -1.215 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -176.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -63.8 -18.42 63.92 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 121.472 1.448 . . . . 0.0 111.587 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.7 -15.25 55.04 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 121.748 -0.595 . . . . 0.0 111.189 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.76 -16.21 63.27 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 121.468 0.652 . . . . 0.0 109.353 175.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.5 mt -81.02 3.4 23.21 Favored 'General case' 0 C--O 1.214 -0.809 0 CA-C-N 114.496 -1.229 . . . . 0.0 110.547 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.81 10.85 2.89 Favored 'General case' 0 C--N 1.288 -2.095 0 O-C-N 121.366 -0.834 . . . . 0.0 110.099 170.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 40' ' ' MET . 1.9 t70 -104.72 -167.3 1.33 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.202 -170.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -61.92 -36.39 81.23 Favored 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 118.264 0.484 . . . . 0.0 111.632 -177.093 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.554 ' O ' HD13 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -64.55 -33.82 76.8 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -177.864 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.569 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.77 -33.45 71.7 Favored 'General case' 0 C--O 1.171 -3.074 0 CA-C-O 118.435 -0.793 . . . . 0.0 111.1 -178.899 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 8.1 pt-20 -64.05 -34.18 77.43 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.235 0.925 . . . . 0.0 110.477 -176.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -71.81 -45.62 60.92 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.819 0.818 . . . . 0.0 109.379 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.562 HD22 ' HA ' ' A' ' 40' ' ' MET . 0.3 OUTLIER -57.01 -52.61 64.59 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 113.946 -1.479 . . . . 0.0 110.808 -179.147 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 40' ' ' MET . 27.6 m -69.97 -32.02 50.0 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.487 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.347 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.64 -48.86 74.28 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 175.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.584 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 9.7 t80 -63.92 -48.66 75.69 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.943 174.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.419 ' CB ' HG13 ' A' ' 19' ' ' VAL . . . -61.03 -40.66 94.43 Favored 'General case' 0 C--O 1.196 -1.752 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.498 -176.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 mttm -66.09 -42.28 89.54 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 123.676 0.79 . . . . 0.0 111.533 178.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.0 pttp -65.47 -40.65 93.4 Favored 'General case' 0 C--O 1.254 1.309 0 CA-C-O 121.443 0.639 . . . . 0.0 110.19 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.424 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 78.3 t -71.56 -47.5 57.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.519 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -57.93 -47.68 82.15 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 123.53 0.732 . . . . 0.0 109.269 179.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.31 -39.46 92.65 Favored Glycine 0 CA--C 1.505 -0.551 0 O-C-N 123.673 0.608 . . . . 0.0 112.104 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.0 -54.26 48.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.034 0.445 . . . . 0.0 110.804 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.518 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -67.89 -29.3 68.37 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 179.019 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -61.63 -54.39 43.54 Favored 'General case' 0 C--O 1.2 -1.526 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 176.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -74.02 -22.12 59.7 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.826 -0.546 . . . . 0.0 111.815 -176.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -79.96 -21.5 43.7 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-O 120.715 0.293 . . . . 0.0 111.01 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.05 165.14 17.76 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -176.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -107.08 -0.74 22.68 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.306 177.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.9 p -162.86 159.08 23.42 Favored 'General case' 0 CA--C 1.482 -1.648 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.457 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.28 -24.73 61.39 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 119.016 -1.074 . . . . 0.0 110.344 178.531 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -63.62 -47.31 81.9 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -63.23 -47.98 80.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.785 176.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.414 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -61.85 -45.7 92.66 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 123.156 0.285 . . . . 0.0 110.753 -176.977 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -62.2 -47.01 86.34 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.961 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.547 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 14.6 t60 -57.78 -54.59 45.12 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.408 0.443 . . . . 0.0 111.195 -178.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.518 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.5 pp -67.71 -32.11 72.52 Favored 'General case' 0 C--O 1.245 0.833 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -175.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.822 HD21 HD23 ' A' ' 18' ' ' LEU . 1.2 pp -75.65 -31.0 59.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.554 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -67.23 -34.22 77.0 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.948 176.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 10.6 mm-40 -66.8 -44.34 81.48 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.631 0.729 . . . . 0.0 109.318 176.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -42.59 86.45 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.096 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.554 HG22 ' HA ' ' A' ' 69' ' ' ALA . 6.0 tt -65.12 -46.61 90.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 C-N-CA 119.999 -0.681 . . . . 0.0 110.67 -178.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.698 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 59.4 t80 -50.65 -54.23 24.59 Favored 'General case' 0 C--O 1.268 2.043 0 C-N-CA 125.808 1.643 . . . . 0.0 110.764 177.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -63.74 -31.66 72.9 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.705 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.76 -37.57 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.475 177.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.552 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 31.4 mt-30 -68.04 -42.04 81.16 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.832 -177.229 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.698 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.4 OUTLIER -70.24 -30.4 67.46 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 119.199 -1.001 . . . . 0.0 112.205 176.27 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.82 -45.42 89.7 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 176.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.601 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -65.95 -41.2 91.59 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.536 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 16.0 pt-20 -69.86 -41.61 74.62 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.593 -177.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 8.4 pt-20 -65.79 -44.41 85.83 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.308 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.415 ' HE2' ' HB2' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -65.18 -42.37 93.72 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.158 -175.952 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.415 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 54.4 ttp180 . . . . . 0 C--O 1.243 0.755 0 C-N-CA 120.93 -0.308 . . . . 0.0 110.89 -178.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 114' ' ' LEU . . . . . 0.601 HD21 ' HB3' ' A' ' 79' ' ' LEU . 40.6 tp . . . . . 0 C--O 1.188 -2.175 0 N-CA-C 111.4 0.148 . . . . 0.0 111.4 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.4 tp -69.9 -45.41 67.69 Favored 'General case' 0 C--O 1.246 0.907 0 O-C-N 121.88 -0.513 . . . . 0.0 110.412 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 35.7 m -61.56 -33.2 73.44 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.01 177.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 117' ' ' SER . . . . . 0.502 ' HB3' ' CD1' ' A' ' 27' ' ' PHE . 19.8 m -77.67 -43.49 31.07 Favored 'General case' 0 CA--C 1.56 1.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.808 176.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 6.7 t70 . . . . . 0 N--CA 1.487 1.422 0 C-N-CA 124.799 1.24 . . . . 0.0 111.339 -175.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 141' ' ' MET . . . . . . . . . . . . . 58.0 mtm . . . . . 0 C--O 1.188 -2.152 0 CA-C-O 118.541 -0.743 . . . . 0.0 112.834 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -25.07 -60.25 0.06 Allowed 'General case' 0 N--CA 1.51 2.559 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 -168.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 5.2 p -61.27 -43.57 98.66 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 122.238 1.018 . . . . 0.0 111.128 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 45.9 mm -70.2 -38.33 74.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.837 0 CA-C-N 114.005 -1.452 . . . . 0.0 109.73 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 18.3 mm -54.7 -49.65 66.41 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.923 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.553 175.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -58.69 -65.11 0.71 Allowed 'General case' 0 N--CA 1.43 -1.442 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.308 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 65.3 m -61.97 -54.79 36.87 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -174.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -81.47 -35.59 30.34 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -174.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 9.1 tt . . . . . 0 N--CA 1.438 -1.056 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -170.895 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.525 0 N-CA-C 109.764 -1.335 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 73.3 t 67.19 133.89 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 121.671 0.748 . . . . 0.0 111.812 178.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.92 108.28 11.06 Favored 'General case' 0 CA--C 1.467 -2.238 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.642 177.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 10.0 ptpp? -130.9 95.91 3.94 Favored 'General case' 0 N--CA 1.39 -3.466 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.553 177.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -62.25 -9.74 24.54 Favored Glycine 0 C--O 1.238 0.376 0 CA-C-N 114.391 -1.277 . . . . 0.0 115.158 -174.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.48 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 66.0 p-90 -68.55 -9.13 47.43 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 117.196 0.498 . . . . 0.0 112.067 178.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.41 ' HD2' ' O ' ' A' ' 4' ' ' LYS . 21.7 p80 -58.54 -24.09 59.84 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-O 120.918 0.389 . . . . 0.0 111.797 177.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.18 -10.6 59.71 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.171 0.51 . . . . 0.0 110.406 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -105.47 10.88 33.1 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.398 0.618 . . . . 0.0 110.53 -176.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.49 HG23 HD12 ' A' ' 14' ' ' LEU . 7.5 p -139.86 128.57 27.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 p -106.66 162.09 14.06 Favored 'General case' 0 CA--C 1.473 -1.986 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.482 ' HA ' ' HD3' ' A' ' 15' ' ' ARG . 0.8 OUTLIER -53.63 -41.58 66.86 Favored 'General case' 0 N--CA 1.422 -1.845 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.596 176.324 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.572 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 6.2 t70 -58.69 -40.85 84.82 Favored 'General case' 0 C--O 1.203 -1.394 0 O-C-N 122.951 0.157 . . . . 0.0 111.225 178.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.49 HD12 HG23 ' A' ' 10' ' ' VAL . 3.1 tm? -69.3 -50.15 49.4 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 -175.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.491 ' O ' HG23 ' A' ' 19' ' ' VAL . 13.4 ptm180 -63.79 -46.15 86.5 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 114.876 -1.056 . . . . 0.0 111.623 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.7 t -67.48 -26.66 66.48 Favored 'General case' 0 CA--C 1.556 1.186 0 CA-C-O 121.033 0.444 . . . . 0.0 110.37 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.572 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 12.3 t60 -68.1 -49.41 61.33 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.627 HD23 HD21 ' A' ' 68' ' ' LEU . 1.2 mp -60.25 -49.55 77.15 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.524 176.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.535 HG13 ' CB ' ' A' ' 47' ' ' ALA . 21.4 t -52.13 -43.3 37.82 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.765 0 C-N-CA 124.581 1.153 . . . . 0.0 109.034 177.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -58.51 -44.93 89.65 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 122.751 0.42 . . . . 0.0 110.396 177.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.557 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 2.5 mptp? -65.03 -35.57 81.58 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.576 175.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.453 HD21 ' HZ1' ' A' ' 71' ' ' LYS . 9.0 mp -55.5 -44.72 76.84 Favored 'General case' 0 CA--C 1.476 -1.897 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.816 176.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.63 HG11 ' HE1' ' A' ' 40' ' ' MET . 78.6 t -58.77 -47.15 90.06 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.919 0 O-C-N 124.134 0.896 . . . . 0.0 110.688 174.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -56.86 -33.76 67.14 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.986 0.422 . . . . 0.0 111.869 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.87 -45.7 15.14 Favored 'General case' 0 C--O 1.192 -1.943 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 177.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.54 HG22 ' HA ' ' A' ' 23' ' ' VAL . 3.2 tt -71.55 -35.27 55.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 O-C-N 121.105 -0.997 . . . . 0.0 110.218 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -119.2 96.88 50.32 Favored Pre-proline 0 N--CA 1.398 -3.036 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 -179.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.97 96.68 0.1 Allowed 'Trans proline' 0 C--O 1.256 1.408 0 C-N-CA 121.616 1.544 . . . . 0.0 108.444 171.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.7 t -75.81 134.8 71.64 Favored Pre-proline 0 N--CA 1.411 -2.413 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.144 -172.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -73.68 -20.97 19.6 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 122.619 2.213 . . . . 0.0 111.487 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -159.31 144.14 11.45 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 -177.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -57.52 -19.74 38.04 Favored 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 122.512 2.141 . . . . 0.0 114.091 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.43 -11.69 59.91 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 121.122 -0.986 . . . . 0.0 112.162 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.83 -8.1 56.7 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.076 0.941 . . . . 0.0 109.269 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 30.7 mt -90.12 2.1 55.67 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.864 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 36' ' ' LYS . 15.1 ptpt -133.8 23.94 3.96 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 122.448 1.118 . . . . 0.0 108.144 178.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.676 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 25.4 t70 -98.18 176.43 5.74 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 113.778 -1.556 . . . . 0.0 110.269 -175.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.676 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.55 -23.2 61.72 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 123.387 0.675 . . . . 0.0 111.132 178.5 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.528 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 41.9 ttm180 -72.94 -26.38 61.36 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 176.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.797 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.5 tpp -61.07 -38.62 86.87 Favored 'General case' 0 C--O 1.193 -1.87 0 CA-C-N 114.518 -1.219 . . . . 0.0 112.636 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 7.2 pt-20 -59.24 -32.07 69.65 Favored 'General case' 0 C--O 1.204 -1.295 0 C-N-CA 118.886 -1.126 . . . . 0.0 110.757 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -75.46 -46.29 33.44 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 123.839 0.855 . . . . 0.0 110.29 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 68.4 mt -63.82 -47.07 82.3 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.793 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.797 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.5 p -72.16 -28.55 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.938 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.58 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -57.06 -47.35 81.19 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 176.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.536 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 1.6 t80 -61.28 -47.99 83.44 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.833 174.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.535 ' CB ' HG13 ' A' ' 19' ' ' VAL . . . -59.52 -44.2 93.22 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.757 -176.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -62.38 -42.47 99.44 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.433 0.693 . . . . 0.0 111.314 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 55.8 pttt -69.27 -39.72 78.22 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.297 0.57 . . . . 0.0 110.635 -177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 49.4 t -69.5 -47.8 70.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.002 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' OE2' HD22 ' A' ' 68' ' ' LEU . 12.6 mm-40 -60.73 -37.54 82.09 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.559 178.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.87 -39.19 97.19 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.54 -0.755 . . . . 0.0 112.082 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.24 -52.84 63.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.807 0.337 . . . . 0.0 110.515 177.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.472 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -68.87 -30.15 68.6 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 179.332 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.44 -47.32 86.63 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 175.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.62 -19.15 55.98 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.298 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.0 t -79.22 -27.83 42.49 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.208 0.528 . . . . 0.0 110.176 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -92.76 165.29 13.01 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-O 121.627 0.727 . . . . 0.0 112.692 -175.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -116.95 18.41 14.71 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.436 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.8 p -168.45 158.54 9.72 Favored 'General case' 0 CA--C 1.49 -1.34 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 173.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HA ' ' HD1' ' A' ' 64' ' ' TYR . 0.0 OUTLIER -71.85 -30.7 65.72 Favored 'General case' 0 C--N 1.312 -1.046 0 C-N-CA 119.408 -0.917 . . . . 0.0 109.969 177.919 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -58.78 -47.49 84.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.111 -0.949 . . . . 0.0 108.911 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -65.86 -46.41 78.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.392 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.435 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -63.33 -45.07 92.98 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -176.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.434 ' HA ' ' CD2' ' A' ' 68' ' ' LEU . 7.6 t80 -63.55 -39.7 95.09 Favored 'General case' 0 N--CA 1.428 -1.529 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.601 178.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -62.7 -55.86 22.94 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.472 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.4 pp -65.35 -33.14 75.27 Favored 'General case' 0 C--O 1.255 1.39 0 CA-C-O 121.598 0.713 . . . . 0.0 111.482 -175.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.627 HD21 HD23 ' A' ' 18' ' ' LEU . 1.4 pp -73.42 -32.41 64.4 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.909 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.527 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -68.44 -33.97 75.14 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.674 178.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -66.1 -43.16 88.05 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.403 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.508 ' NZ ' ' HB2' ' A' ' 68' ' ' LEU . 1.4 pptp? -65.17 -42.67 93.44 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 119.811 -0.756 . . . . 0.0 111.925 179.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.605 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.1 tt -65.94 -40.42 87.37 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.693 0 CA-C-O 121.006 0.432 . . . . 0.0 110.163 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.517 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 62.6 t80 -57.33 -52.86 63.64 Favored 'General case' 0 C--O 1.272 2.261 0 C-N-CA 124.963 1.305 . . . . 0.0 110.495 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -64.38 -33.07 75.0 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.225 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -65.72 -38.31 81.98 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.992 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.609 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 53.0 mt-30 -69.62 -43.86 71.84 Favored 'General case' 0 N--CA 1.443 -0.8 0 C-N-CA 120.391 -0.523 . . . . 0.0 110.626 -175.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.517 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.2 OUTLIER -70.44 -28.24 64.87 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 118.648 -1.221 . . . . 0.0 112.782 175.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -61.74 -49.41 76.51 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 175.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.4 pp -64.84 -40.45 95.2 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.76 -176.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.432 ' N ' HD12 ' A' ' 79' ' ' LEU . 45.9 mt-10 -62.68 -50.42 71.22 Favored 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 123.665 0.603 . . . . 0.0 112.211 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.5 pt-20 -72.57 -32.09 65.75 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 119.708 -0.797 . . . . 0.0 112.787 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.54 -35.23 80.23 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -77.61 -39.18 46.26 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.027 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.429 ' O ' ' HB2' ' A' ' 85' ' ' SER . 7.8 tmm_? -70.79 -58.68 3.38 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 118.605 -0.712 . . . . 0.0 111.523 -177.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 30.3 t 167.8 104.25 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.418 0.687 . . . . 0.0 111.429 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.435 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 1.6 ptp180 -132.93 -31.8 1.27 Allowed 'General case' 0 C--N 1.316 -0.868 0 O-C-N 121.505 -0.747 . . . . 0.0 109.846 169.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.434 ' HG ' ' HG3' ' A' ' 86' ' ' ARG . 69.3 mt . . . . . 0 C--O 1.249 1.049 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.519 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 26.3 t -154.93 140.23 17.65 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 106.725 -1.584 . . . . 0.0 106.725 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.445 ' O ' ' HG3' ' B' ' 112' ' ' GLN . 22.9 ptp -74.41 -21.22 59.74 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.541 -178.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 32.8 t -90.37 -84.93 0.23 Allowed 'General case' 0 N--CA 1.421 -1.889 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 63.2 t-80 65.3 -42.09 0.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 126.055 1.742 . . . . 0.0 114.418 175.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . 0.48 ' HA ' ' OE1' ' B' ' 109' ' ' GLN . 80.1 t80 84.19 127.5 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 126.699 2.0 . . . . 0.0 109.118 -169.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 90.65 -21.01 35.03 Favored Glycine 0 C--O 1.214 -1.096 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -89.35 1.2 56.12 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 124.317 1.047 . . . . 0.0 109.754 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.48 ' OE1' ' HA ' ' B' ' 106' ' ' TYR . 1.9 mp0 -60.67 -33.65 73.14 Favored 'General case' 0 CA--C 1.498 -1.024 0 CA-C-N 115.047 -0.978 . . . . 0.0 109.985 178.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . 0.584 ' O ' ' HB2' ' B' ' 114' ' ' LEU . 19.6 p -58.17 -52.74 64.28 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.36 -179.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 64.1 tp -61.56 -50.57 72.1 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.806 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' B' ' 103' ' ' MET . 15.6 mm100 -64.67 -52.58 56.5 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -175.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -68.71 -36.8 78.91 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.392 -173.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.584 ' HB2' ' O ' ' B' ' 110' ' ' THR . 0.2 OUTLIER -73.66 -31.92 63.73 Favored 'General case' 0 C--O 1.212 -0.9 0 C-N-CA 120.48 -0.488 . . . . 0.0 111.315 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' B' ' 118' ' ' ASP . 51.6 tp -67.4 -41.85 84.25 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 175.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.8 m -65.71 -39.46 91.22 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.27 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.502 ' HA ' ' HB2' ' B' ' 120' ' ' LEU . 22.5 m -77.37 -20.65 54.45 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 121.386 0.613 . . . . 0.0 111.375 178.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' B' ' 115' ' ' LEU . 9.8 t70 -66.56 -48.96 67.97 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 22.8 m -72.72 -9.46 58.66 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.271 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.506 HD23 ' O ' ' B' ' 120' ' ' LEU . 4.6 tt -72.02 -8.92 57.32 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 20.9 t -60.24 -45.28 93.8 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -90.42 73.45 6.96 Favored 'General case' 0 N--CA 1.432 -1.373 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 173.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 49.7 m -153.82 167.38 29.87 Favored 'General case' 0 C--O 1.256 1.421 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -90.1 -80.67 0.31 Allowed 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -173.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 121.3 -140.49 14.02 Favored Glycine 0 N--CA 1.44 -1.097 0 C-N-CA 120.555 -0.831 . . . . 0.0 111.27 -177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -123.2 -108.0 1.87 Allowed Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.999 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -152.54 -29.83 0.04 OUTLIER Glycine 0 C--N 1.31 -0.887 0 C-N-CA 121.397 -0.43 . . . . 0.0 112.777 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 15.8 m -84.28 176.71 8.55 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.872 0.367 . . . . 0.0 111.225 -176.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -127.04 -108.68 1.55 Allowed Glycine 0 N--CA 1.439 -1.155 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -149.0 175.18 28.36 Favored Glycine 0 C--O 1.252 1.243 0 C-N-CA 121.001 -0.619 . . . . 0.0 111.958 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -157.48 154.42 25.52 Favored Glycine 0 N--CA 1.439 -1.138 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 14.2 t -147.78 -165.23 2.2 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 109.047 -0.724 . . . . 0.0 109.047 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 136.91 126.86 2.57 Favored Glycine 0 C--O 1.245 0.804 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -177.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . 0.421 ' N ' ' HB2' ' A' ' 13' ' ' ASP . . . 145.46 -131.97 4.42 Favored Glycine 0 C--N 1.31 -0.874 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -179.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . 0.415 ' HA2' ' OE1' ' B' ' 138' ' ' GLU . . . 132.89 109.51 1.16 Allowed Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.473 -0.87 . . . . 0.0 111.712 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 20.2 m -147.88 -61.12 0.26 Allowed 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.16 0.505 . . . . 0.0 111.075 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.676 ' O ' ' HB2' ' B' ' 141' ' ' MET . 86.2 mt -101.0 -45.12 5.51 Favored 'General case' 0 C--O 1.216 -0.71 0 O-C-N 122.149 -0.344 . . . . 0.0 111.156 -173.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.476 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 0.0 OUTLIER -50.98 -42.89 60.44 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 124.866 1.266 . . . . 0.0 112.865 -177.213 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 39.0 m -39.38 -58.12 1.28 Allowed 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.48 1.512 . . . . 0.0 114.154 -174.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -121.25 32.02 6.1 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 123.038 1.399 . . . . 0.0 110.17 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.676 ' HB2' ' O ' ' B' ' 137' ' ' LEU . 26.3 ttp -93.33 -9.37 39.08 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 114.858 -1.064 . . . . 0.0 110.038 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -14.82 -71.98 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 127.22 2.208 . . . . 0.0 116.711 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 20.2 m -70.5 -38.8 74.36 Favored 'General case' 0 C--N 1.311 -1.099 0 O-C-N 122.01 -0.432 . . . . 0.0 111.623 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 66.8 mt -66.88 -45.95 86.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.406 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 14.7 tt -66.04 -37.21 79.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.349 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? -61.29 -52.84 63.02 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.6 t -68.63 -54.06 18.74 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -176.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -80.96 -37.4 29.46 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -173.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.527 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 52.7 tp -84.84 -24.82 28.44 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.205 0.457 . . . . 0.0 109.932 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 28.3 ttt 82.9 89.76 0.03 OUTLIER 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 173.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -107.93 88.93 2.85 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 106.007 -1.849 . . . . 0.0 106.007 168.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.259 1.575 0 O-C-N 123.848 0.717 . . . . 0.0 111.566 -173.74 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.517 0 N-CA-C 110.471 -1.051 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 15.3 m -81.65 114.11 22.06 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.18 108.44 18.91 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 122.542 1.163 . . . . 0.0 111.432 -171.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.513 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 39.1 mttp -95.41 118.62 32.47 Favored 'General case' 0 C--N 1.273 -2.718 0 CA-C-N 114.555 -1.202 . . . . 0.0 110.061 -172.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -67.22 -17.42 68.13 Favored Glycine 0 C--N 1.317 -0.495 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.497 -176.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.513 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 63.1 p-90 -68.19 -10.25 52.96 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.48 -17.61 59.96 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -81.67 -9.46 59.65 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-O 121.162 0.506 . . . . 0.0 109.989 177.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.434 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 53.5 m-70 -101.63 9.66 40.9 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.91 -178.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.6 p -140.05 110.86 4.19 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.732 0 CA-C-O 122.24 1.019 . . . . 0.0 109.429 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.6 m -88.38 161.29 17.17 Favored 'General case' 0 C--N 1.289 -2.035 0 CA-C-N 115.095 -0.957 . . . . 0.0 108.705 -176.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -36.9 64.83 Favored 'General case' 0 C--O 1.195 -1.81 0 C-N-CA 122.891 0.477 . . . . 0.0 110.17 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -52.09 -46.43 65.22 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 123.919 0.888 . . . . 0.0 113.134 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.505 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -70.19 -50.64 38.08 Favored 'General case' 0 CA--C 1.497 -1.075 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -174.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.543 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.1 ptm180 -64.17 -44.65 91.42 Favored 'General case' 0 N--CA 1.421 -1.891 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.12 -177.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.0 t -63.66 -30.48 71.58 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 122.966 0.507 . . . . 0.0 110.546 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -65.31 -47.22 77.35 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.817 HD23 HD21 ' A' ' 68' ' ' LEU . 5.4 mp -65.61 -40.92 93.15 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.476 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.2 t -58.84 -46.4 91.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.886 0 C-N-CA 124.636 1.174 . . . . 0.0 110.166 176.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -57.32 -51.91 67.49 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.326 177.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.2 mttp -62.26 -40.33 95.83 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.692 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.523 ' O ' HG22 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -51.84 -52.61 48.1 Favored 'General case' 0 CA--C 1.508 -0.667 0 C-N-CA 124.401 1.08 . . . . 0.0 108.922 176.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.467 HG13 ' HB3' ' A' ' 43' ' ' LEU . 39.4 t -54.1 -51.22 48.8 Favored 'Isoleucine or valine' 0 C--O 1.187 -2.207 0 O-C-N 124.308 1.005 . . . . 0.0 110.752 176.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -56.92 -34.57 68.08 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -176.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.37 -46.76 14.19 Favored 'General case' 0 C--O 1.195 -1.795 0 C-N-CA 120.404 -0.518 . . . . 0.0 111.74 177.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.616 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.84 -26.49 17.84 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 CA-C-O 122.063 0.935 . . . . 0.0 110.95 -174.073 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.616 ' CD2' HG23 ' A' ' 26' ' ' ILE . 69.4 m-85 -124.94 91.66 49.0 Favored Pre-proline 0 C--N 1.283 -2.305 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.129 179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -65.68 102.02 0.49 Allowed 'Trans proline' 0 C--O 1.247 0.943 0 C-N-CA 122.134 1.89 . . . . 0.0 111.001 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.451 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 12.7 t -77.23 136.99 64.83 Favored Pre-proline 0 N--CA 1.423 -1.792 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.227 -176.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -76.5 -27.49 7.63 Favored 'Trans proline' 0 C--O 1.244 0.783 0 C-N-CA 122.974 2.449 . . . . 0.0 112.154 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -147.52 149.19 33.42 Favored Pre-proline 0 CA--C 1.485 -1.528 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -67.29 -9.91 26.85 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 121.626 1.551 . . . . 0.0 111.702 177.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.24 -10.44 57.69 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.15 0.5 . . . . 0.0 111.522 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.451 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -81.11 -6.56 58.97 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.936 0.874 . . . . 0.0 109.025 176.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.553 ' HA ' ' HE3' ' A' ' 40' ' ' MET . 21.8 mt -90.85 5.55 48.03 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.366 -178.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -133.48 17.71 3.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.107 0.956 . . . . 0.0 108.926 177.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.656 ' OD2' ' HD2' ' A' ' 38' ' ' ARG . 15.3 t70 -88.54 176.69 7.04 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.974 -176.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.656 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.8 OUTLIER -71.29 -26.72 62.99 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 173.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.584 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 32.2 ttm180 -59.4 -36.05 75.11 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.933 -1.03 . . . . 0.0 109.391 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.553 ' HE3' ' HA ' ' A' ' 35' ' ' LEU . 8.6 tpp -58.75 -37.89 77.22 Favored 'General case' 0 C--O 1.212 -0.905 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.869 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -66.76 -27.83 67.92 Favored 'General case' 0 C--O 1.207 -1.136 0 C-N-CA 117.947 -1.501 . . . . 0.0 110.072 -178.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -75.03 -42.06 57.97 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 123.522 0.729 . . . . 0.0 110.208 176.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.589 HD22 ' CG ' ' A' ' 27' ' ' PHE . 28.3 mt -61.92 -53.57 53.95 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.878 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.416 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 9.0 p -70.22 -27.79 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.597 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.267 -178.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.67 84.96 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.938 0.399 . . . . 0.0 110.199 175.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.54 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 4.3 t80 -60.29 -44.7 95.16 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.889 175.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.3 -41.93 97.82 Favored 'General case' 0 C--O 1.199 -1.58 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.485 -177.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.5 mttm -64.65 -44.22 91.14 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 176.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 58.2 pttt -63.8 -40.55 96.92 Favored 'General case' 0 C--O 1.256 1.424 0 CA-C-O 121.544 0.688 . . . . 0.0 110.373 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.457 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 48.7 t -70.74 -45.32 74.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 114.933 -1.031 . . . . 0.0 110.694 178.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.408 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.9 tm-20 -56.98 -46.2 82.41 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.75 -37.05 92.95 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.624 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -61.04 -52.98 62.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.012 0.434 . . . . 0.0 110.592 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.554 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -69.85 -27.75 65.1 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 179.04 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -62.83 -49.5 74.67 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 175.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -74.5 -19.51 60.34 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.7 t -79.65 -20.08 47.58 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 120.717 0.294 . . . . 0.0 110.78 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.52 161.67 13.55 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -174.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -107.86 5.6 26.6 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.47 -1.241 . . . . 0.0 110.53 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 75.5 p -164.02 159.51 20.74 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.434 ' NE ' ' HB3' ' A' ' 9' ' ' HIS . 0.2 OUTLIER -72.51 -24.07 61.1 Favored 'General case' 0 C--O 1.197 -1.677 0 C-N-CA 118.91 -1.116 . . . . 0.0 109.818 177.746 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -66.02 -44.46 84.63 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -66.3 -46.34 77.29 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.282 175.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.409 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.1 -45.36 89.01 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 123.157 0.286 . . . . 0.0 110.54 -177.474 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -60.07 -44.09 95.0 Favored 'General case' 0 N--CA 1.434 -1.226 0 O-C-N 123.762 0.664 . . . . 0.0 110.566 177.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.42 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 15.4 t-80 -64.75 -50.98 64.74 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.0 pp -67.3 -32.2 73.03 Favored 'General case' 0 C--O 1.252 1.198 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.218 -174.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.817 HD21 HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -75.95 -31.48 59.08 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 178.268 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.491 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -64.51 -35.28 80.45 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.798 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 12.6 mt-10 -72.17 -40.55 67.89 Favored 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 120.304 -0.558 . . . . 0.0 109.985 179.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.75 -38.87 87.5 Favored 'General case' 0 C--O 1.212 -0.894 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.667 -179.103 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.623 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.9 tt -68.69 -42.94 83.39 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.291 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -57.22 -51.75 68.07 Favored 'General case' 0 C--O 1.275 2.432 0 C-N-CA 124.64 1.176 . . . . 0.0 110.793 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.9 -36.9 85.87 Favored 'General case' 0 C--O 1.21 -0.988 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.674 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.3 mp -61.36 -39.82 84.06 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 O-C-N 123.451 0.469 . . . . 0.0 110.182 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.623 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 50.2 mt-30 -64.18 -49.9 70.23 Favored 'General case' 0 CA--C 1.496 -1.1 0 O-C-N 123.636 0.585 . . . . 0.0 110.286 -177.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.451 ' H ' ' HG2' ' A' ' 77' ' ' LYS . 0.8 OUTLIER -73.28 -28.22 61.99 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 118.786 -1.166 . . . . 0.0 113.922 179.377 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -64.58 -47.79 77.38 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.0 pp -64.93 -38.99 92.8 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.58 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 76' ' ' GLN . 52.4 mt-10 -58.49 -54.45 46.94 Favored 'General case' 0 CA--C 1.49 -1.332 0 O-C-N 123.992 0.807 . . . . 0.0 110.302 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 86' ' ' ARG . 10.6 pt-20 -68.39 -39.05 81.86 Favored 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 120.312 -0.555 . . . . 0.0 112.127 -175.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.456 ' HG3' ' HA ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -66.13 -34.17 77.45 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.687 -178.828 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 -77.73 -44.28 28.31 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-O 121.279 0.562 . . . . 0.0 110.095 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -81.68 -59.3 2.65 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -171.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 71.0 m -154.16 91.36 1.42 Allowed 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -169.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.432 ' CG ' ' HA ' ' A' ' 82' ' ' LYS . 12.1 ptm180 177.3 -34.78 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.427 1.891 . . . . 0.0 110.093 171.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 C--O 1.249 1.038 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.24 176.195 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.358 0 N-CA-C 110.634 -0.987 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 38.9 m -81.02 91.41 6.07 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 120.861 0.363 . . . . 0.0 111.641 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 95.5 mmm -83.39 -29.13 28.41 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 172.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 45.3 t -122.3 145.51 48.17 Favored 'General case' 0 N--CA 1.416 -2.167 0 N-CA-C 104.252 -2.499 . . . . 0.0 104.252 170.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -107.68 -70.93 0.78 Allowed 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.099 -177.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 61.8 t80 58.85 90.76 0.05 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 C-N-CA 125.083 1.353 . . . . 0.0 111.757 -178.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 131.98 -30.43 3.21 Favored Glycine 0 N--CA 1.426 -2.015 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -131.77 58.24 1.74 Allowed 'General case' 0 N--CA 1.435 -1.209 0 CA-C-O 122.083 0.944 . . . . 0.0 112.153 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -64.64 -31.57 72.85 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.847 176.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' B' ' 114' ' ' LEU . 3.4 t -58.88 -33.78 70.89 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.558 176.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 52.9 tp -68.25 -50.89 50.84 Favored 'General case' 0 N--CA 1.438 -1.047 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -68.58 -41.97 78.92 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -62.06 -54.76 36.88 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 122.884 0.474 . . . . 0.0 110.211 -178.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' B' ' 110' ' ' THR . 1.2 mm? -66.38 -31.64 72.53 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.846 -0.616 . . . . 0.0 112.336 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 33.5 tp -65.38 -45.87 82.35 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 122.208 -0.307 . . . . 0.0 110.379 175.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 28.7 m -66.65 -39.74 88.36 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.149 0.5 . . . . 0.0 110.332 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 30.3 m -73.19 -22.5 60.45 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.426 0.631 . . . . 0.0 111.944 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -76.83 -34.83 57.87 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 122.106 0.955 . . . . 0.0 108.614 174.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 37.4 t -77.05 -10.31 59.29 Favored 'General case' 0 CA--C 1.557 1.244 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.231 178.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 13.6 tp -58.77 -12.56 4.46 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.132 1.773 . . . . 0.0 114.158 -174.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 14.3 p -53.92 -21.55 8.14 Favored 'General case' 0 CA--C 1.556 1.196 0 N-CA-C 116.446 2.017 . . . . 0.0 116.446 -170.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 14.4 p80 -78.55 62.39 3.13 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 -175.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 58.7 m 48.31 104.96 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 176.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -138.58 -176.69 4.56 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.105 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 161.29 174.04 30.67 Favored Glycine 0 N--CA 1.424 -2.102 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 106.15 104.43 2.94 Favored Glycine 0 C--N 1.303 -1.28 0 C-N-CA 120.223 -0.989 . . . . 0.0 112.585 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -178.97 -125.82 0.96 Allowed Glycine 0 N--CA 1.426 -1.992 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 48.7 m -153.18 119.22 5.43 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -72.71 171.29 50.26 Favored Glycine 0 C--O 1.242 0.621 0 C-N-CA 121.459 -0.4 . . . . 0.0 112.823 -177.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -177.7 162.6 30.48 Favored Glycine 0 N--CA 1.437 -1.244 0 N-CA-C 111.556 -0.618 . . . . 0.0 111.556 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 146.55 -174.33 26.46 Favored Glycine 0 C--N 1.305 -1.156 0 N-CA-C 110.099 -1.2 . . . . 0.0 110.099 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 16.1 m 66.84 100.39 0.05 OUTLIER 'General case' 0 C--O 1.248 0.997 0 C-N-CA 124.611 1.164 . . . . 0.0 112.118 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -107.99 -102.84 2.81 Favored Glycine 0 N--CA 1.44 -1.065 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.957 -178.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 154.81 4.96 0.1 OUTLIER Glycine 0 C--N 1.308 -0.992 0 C-N-CA 120.713 -0.756 . . . . 0.0 114.153 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 97.63 75.84 1.25 Allowed Glycine 0 CA--C 1.524 0.653 0 C-N-CA 119.994 -1.098 . . . . 0.0 114.546 176.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 35.5 t -97.77 -135.4 0.26 Allowed 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 173.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.532 ' O ' ' HB2' ' B' ' 141' ' ' MET . 95.2 mt -53.64 -27.64 28.3 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 118.319 0.509 . . . . 0.0 111.448 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.476 ' CB ' ' HE2' ' B' ' 141' ' ' MET . 0.0 OUTLIER -68.09 -12.94 61.77 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 -178.097 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 54.0 t -65.04 -31.27 72.42 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.085 0.554 . . . . 0.0 111.283 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -129.26 26.02 5.45 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 122.13 0.967 . . . . 0.0 109.901 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.532 ' HB2' ' O ' ' B' ' 137' ' ' LEU . 45.3 ttp -100.58 -9.93 21.49 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.045 -0.979 . . . . 0.0 112.47 -172.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -35.94 -65.96 0.23 Allowed 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.0 p -66.12 -33.92 76.88 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 121.243 0.544 . . . . 0.0 112.103 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 51.2 mm -67.0 -49.59 72.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.975 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.448 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 21.2 tt -69.7 -31.19 47.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.163 -177.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -57.81 -65.31 0.66 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 20.0 p -67.2 -45.6 76.38 Favored 'General case' 0 C--O 1.247 0.96 0 CA-C-N 114.441 -1.254 . . . . 0.0 113.517 -174.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -80.44 -34.41 36.09 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.491 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 9.1 tt -97.91 -32.05 11.88 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 115.295 1.591 . . . . 0.0 115.295 -170.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . 0.256 0.0 OUTLIER -152.69 157.75 41.36 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 115.545 -2.462 . . . . 0.0 116.784 -176.538 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -167.1 109.1 0.66 Allowed 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 113.924 -1.489 . . . . 0.0 108.886 178.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.308 -1.222 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 178.283 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.482 -2.012 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 33.8 m -101.62 141.19 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.336 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.143 177.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.538 ' HD2' ' H ' ' A' ' 3' ' ' ARG . 0.1 OUTLIER -96.13 34.92 1.5 Allowed 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 122.374 1.083 . . . . 0.0 109.665 -179.151 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.468 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 76.9 mttt -119.89 118.47 30.85 Favored 'General case' 0 N--CA 1.421 -1.89 0 CA-C-N 114.303 -1.317 . . . . 0.0 109.523 -173.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.01 -21.39 31.03 Favored Glycine 0 C--N 1.321 -0.252 0 CA-C-N 115.243 -0.89 . . . . 0.0 114.947 -176.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.468 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 55.7 p-90 -64.13 -14.69 56.69 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 117.365 0.583 . . . . 0.0 112.368 178.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -61.29 -12.88 15.21 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 176.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -81.76 -16.85 49.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.66 0.743 . . . . 0.0 109.833 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -105.32 18.69 21.86 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.825 -171.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -146.67 130.32 9.67 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.831 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.2 m -105.28 162.88 13.04 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 -177.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.15 -36.26 72.72 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 120.792 0.329 . . . . 0.0 110.406 177.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -58.41 -41.33 84.72 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.828 -0.623 . . . . 0.0 112.123 178.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.54 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -68.3 -52.06 37.89 Favored 'General case' 0 CA--C 1.487 -1.453 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 -175.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.575 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.4 ptm180 -63.97 -43.84 94.56 Favored 'General case' 0 N--CA 1.415 -2.2 0 CA-C-N 114.301 -1.318 . . . . 0.0 112.849 -176.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 t -66.71 -28.3 68.32 Favored 'General case' 0 N--CA 1.44 -0.962 0 N-CA-C 110.237 -0.282 . . . . 0.0 110.237 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.7 t60 -68.02 -41.98 81.35 Favored 'General case' 0 C--O 1.241 0.644 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.78 HD23 HD21 ' A' ' 68' ' ' LEU . 5.0 mp -67.02 -40.67 87.29 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.173 -0.922 . . . . 0.0 109.704 177.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 15' ' ' ARG . 76.6 t -56.85 -47.9 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.049 0.94 . . . . 0.0 109.793 174.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.483 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 23.1 t-80 -54.85 -52.23 63.41 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.367 177.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.4 mttp -61.77 -39.76 92.8 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.428 177.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.479 ' O ' HG22 ' A' ' 26' ' ' ILE . 8.8 mt -52.37 -52.55 52.89 Favored 'General case' 0 CA--C 1.506 -0.748 0 C-N-CA 123.463 0.705 . . . . 0.0 111.0 175.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.2 t -54.92 -48.7 74.51 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.373 0 O-C-N 124.0 0.812 . . . . 0.0 109.869 176.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 40.2 mt-30 -57.55 -34.65 69.38 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -175.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.15 -45.54 15.0 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 176.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.531 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.6 -23.42 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 121.988 0.899 . . . . 0.0 110.439 -174.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD2' HG23 ' A' ' 26' ' ' ILE . 66.1 m-85 -133.2 84.62 47.22 Favored Pre-proline 0 C--N 1.284 -2.242 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.18 106.46 0.3 Allowed 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.636 2.224 . . . . 0.0 111.194 -177.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.408 HG21 HD21 ' A' ' 35' ' ' LEU . 7.4 t -83.73 137.16 41.34 Favored Pre-proline 0 N--CA 1.425 -1.709 0 CA-C-O 121.124 0.488 . . . . 0.0 111.625 -172.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.474 ' HD3' ' OG ' ' B' ' 121' ' ' SER . 73.7 Cg_endo -80.74 -19.93 8.21 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.787 2.325 . . . . 0.0 112.315 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -158.53 159.06 29.93 Favored Pre-proline 0 C--N 1.309 -1.172 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.705 -176.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.568 ' HA ' HD12 ' A' ' 35' ' ' LEU . 58.6 Cg_endo -77.17 -1.46 11.63 Favored 'Trans proline' 0 N--CA 1.442 -1.504 0 C-N-CA 121.446 1.431 . . . . 0.0 113.876 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -95.34 -17.12 21.87 Favored 'General case' 0 N--CA 1.442 -0.868 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.692 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.9 -16.05 63.66 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 122.189 0.995 . . . . 0.0 108.845 172.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 32' ' ' PRO . 33.3 mt -87.36 1.23 53.92 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.276 -1.329 . . . . 0.0 111.374 -179.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -133.04 24.16 4.22 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-O 122.407 1.099 . . . . 0.0 108.888 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.58 ' O ' ' HB3' ' A' ' 40' ' ' MET . 25.6 t70 -82.36 170.92 14.78 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 114.053 -1.43 . . . . 0.0 108.151 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.552 ' HD2' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.81 -25.5 62.89 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-O 121.903 0.859 . . . . 0.0 109.743 179.115 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.541 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 21.4 ttp180 -77.4 -15.78 59.18 Favored 'General case' 0 C--O 1.251 1.139 0 C-N-CA 124.442 1.097 . . . . 0.0 110.204 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.615 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.5 tpp -59.55 -32.94 70.8 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.068 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.426 ' HA ' HG12 ' A' ' 44' ' ' VAL . 0.5 OUTLIER -62.32 -33.55 74.91 Favored 'General case' 0 C--O 1.184 -2.349 0 C-N-CA 119.003 -1.079 . . . . 0.0 110.595 -179.771 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.429 HD22 HD23 ' A' ' 43' ' ' LEU . 5.1 t30 -70.99 -46.14 62.79 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 121.266 0.555 . . . . 0.0 109.556 178.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 18.7 mt -59.36 -51.09 71.4 Favored 'General case' 0 C--O 1.245 0.868 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.11 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.615 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -72.86 -28.59 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.058 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.728 -177.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.37 -46.42 90.25 Favored 'General case' 0 C--O 1.246 0.896 0 N-CA-C 109.794 -0.446 . . . . 0.0 109.794 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.5 t80 -59.58 -47.04 87.12 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.773 173.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.78 -41.63 95.95 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.771 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -63.02 -46.27 88.37 Favored 'General case' 0 C--O 1.216 -0.676 0 O-C-N 123.46 0.475 . . . . 0.0 111.613 176.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.4 pttp -64.37 -38.81 92.36 Favored 'General case' 0 C--O 1.252 1.219 0 CA-C-O 121.631 0.729 . . . . 0.0 110.885 -176.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.427 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 51.7 t -72.1 -45.26 63.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.551 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.433 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.8 tm-20 -57.07 -45.33 83.36 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 177.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.02 -40.06 95.05 Favored Glycine 0 N--CA 1.439 -1.106 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.273 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -61.12 -52.93 62.82 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.173 0.511 . . . . 0.0 111.195 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.437 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -67.4 -30.35 70.1 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 178.475 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -63.06 -53.76 48.73 Favored 'General case' 0 C--O 1.196 -1.759 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -73.04 -20.97 60.88 Favored 'General case' 0 C--N 1.309 -1.171 0 O-C-N 122.048 -0.407 . . . . 0.0 111.463 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 21.8 t -77.67 -42.49 34.47 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.2 162.39 28.46 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -173.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -102.89 4.53 37.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.147 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.421 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 66.7 p -160.17 160.04 32.39 Favored 'General case' 0 CA--C 1.488 -1.439 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.07 -24.26 61.48 Favored 'General case' 0 C--O 1.206 -1.215 0 C-N-CA 119.289 -0.964 . . . . 0.0 109.152 176.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -68.07 -47.81 67.27 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -61.45 -43.92 98.02 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.462 176.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -48.38 77.03 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 123.36 0.412 . . . . 0.0 110.389 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.528 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 0.3 OUTLIER -60.58 -45.93 92.11 Favored 'General case' 0 N--CA 1.433 -1.311 0 O-C-N 123.882 0.739 . . . . 0.0 110.32 177.785 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.654 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 20.4 m80 -67.41 -42.74 82.78 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -178.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.437 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.0 pp -71.27 -31.63 67.72 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.016 -0.674 . . . . 0.0 110.56 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.78 HD21 HD23 ' A' ' 18' ' ' LEU . 1.7 pp -73.83 -32.85 63.88 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 178.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.484 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.83 -37.31 87.18 Favored 'General case' 0 C--O 1.197 -1.703 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.225 175.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.654 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 69.9 mm-40 -64.16 -43.89 93.76 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-O 121.824 0.821 . . . . 0.0 110.25 177.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -69.88 -41.05 75.28 Favored 'General case' 0 N--CA 1.435 -1.195 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.4 -177.469 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.501 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 5.8 tt -68.5 -34.66 66.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 121.43 0.634 . . . . 0.0 109.467 -178.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.581 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 39.1 t80 -57.49 -54.4 47.26 Favored 'General case' 0 C--O 1.261 1.682 0 C-N-CA 125.8 1.64 . . . . 0.0 109.318 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 71' ' ' LYS . 17.2 ptpt -64.75 -33.84 76.93 Favored 'General case' 0 C--O 1.207 -1.157 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.376 -178.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.436 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -63.61 -38.8 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-O 120.652 0.263 . . . . 0.0 110.858 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.552 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 37.6 mt-30 -69.07 -44.36 72.73 Favored 'General case' 0 CA--C 1.501 -0.942 0 C-N-CA 120.535 -0.466 . . . . 0.0 111.294 -177.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.581 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.3 OUTLIER -72.15 -28.19 63.08 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 118.42 -1.312 . . . . 0.0 112.005 177.453 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.86 -49.04 77.85 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 176.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.65 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -64.15 -42.3 96.81 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.879 -178.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.55 -45.13 95.46 Favored 'General case' 0 N--CA 1.436 -1.175 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -75.39 -32.72 60.87 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 119.837 -0.745 . . . . 0.0 111.936 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.85 -38.26 88.4 Favored 'General case' 0 C--N 1.348 0.504 0 CA-C-O 121.01 0.433 . . . . 0.0 110.133 -178.852 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.44 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 48.3 ttp180 -77.84 -37.76 47.72 Favored 'General case' 0 N--CA 1.427 -1.617 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.608 178.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -77.02 -59.73 2.66 Favored 'General case' 0 N--CA 1.441 -0.923 0 C-N-CA 119.631 -0.828 . . . . 0.0 113.095 -176.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 67.7 m -169.29 110.56 0.47 Allowed 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -174.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.472 ' CD ' ' HA ' ' A' ' 82' ' ' LYS . 16.8 ptm180 -169.92 -34.44 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.573 0.749 . . . . 0.0 110.306 172.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 84.7 mt . . . . . 0 C--O 1.247 0.957 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.736 -178.406 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.677 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 70.0 m 65.22 33.75 9.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 122.044 0.926 . . . . 0.0 111.994 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.81 -10.07 57.54 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 173.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 32.7 t -143.7 105.23 4.3 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 173.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 47.9 m80 -76.03 92.42 3.17 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-O 121.527 0.68 . . . . 0.0 111.961 -178.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . 0.485 ' HA ' HE22 ' B' ' 109' ' ' GLN . 36.2 t80 -145.26 130.11 18.21 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 173.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 96.03 -40.78 2.54 Favored Glycine 0 N--CA 1.439 -1.103 0 N-CA-C 108.794 -1.722 . . . . 0.0 108.794 -175.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -117.01 70.35 0.77 Allowed 'General case' 0 N--CA 1.434 -1.265 0 CA-C-O 122.351 1.072 . . . . 0.0 111.928 176.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.485 HE22 ' HA ' ' B' ' 106' ' ' TYR . 1.2 mp0 -71.64 -35.84 70.52 Favored 'General case' 0 CA--C 1.497 -1.065 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 173.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 11.1 p -55.56 -35.95 66.29 Favored 'General case' 0 N--CA 1.417 -2.077 0 CA-C-N 112.32 -2.218 . . . . 0.0 113.048 -177.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 57.5 tp -58.57 -64.31 0.97 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 -177.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -71.16 -35.36 71.62 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.776 -0.369 . . . . 0.0 111.216 -177.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -61.93 -58.38 8.15 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.424 0.63 . . . . 0.0 110.201 -178.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.65 HD21 ' HB3' ' A' ' 79' ' ' LEU . 26.5 tp -73.56 -19.72 60.82 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.388 -175.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 63.3 tp -70.45 -41.67 72.52 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 172.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 25.6 m -72.24 -42.58 65.51 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.954 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.8 m -62.27 -34.6 76.88 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.245 0.545 . . . . 0.0 110.489 176.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 13.8 t70 -64.3 -43.87 93.38 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 177.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 38.3 m -64.25 -33.35 75.61 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.854 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.459 HD21 ' HD2' ' A' ' 39' ' ' ARG . 8.0 tt -62.67 -39.72 94.82 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 123.267 0.627 . . . . 0.0 110.327 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . 0.474 ' OG ' ' HD3' ' A' ' 30' ' ' PRO . 33.3 t -75.47 -45.08 40.64 Favored 'General case' 0 C--O 1.256 1.399 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 177.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 70.6 t60 78.59 -38.32 0.23 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.312 1.445 . . . . 0.0 113.915 173.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 23.6 m -115.21 155.4 27.26 Favored 'General case' 0 C--N 1.311 -1.102 0 O-C-N 121.962 -0.461 . . . . 0.0 110.993 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -108.04 139.02 43.3 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 122.842 0.457 . . . . 0.0 111.517 -177.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . 0.441 ' N ' ' HA ' ' A' ' 30' ' ' PRO . . . -164.19 -168.48 26.33 Favored Glycine 0 N--CA 1.443 -0.866 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -102.37 135.84 12.48 Favored Glycine 0 N--CA 1.445 -0.732 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -96.1 70.84 0.9 Allowed Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.834 -0.698 . . . . 0.0 113.162 -177.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 8.5 p -79.52 115.1 18.95 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 122.667 0.387 . . . . 0.0 110.626 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -171.03 143.38 7.64 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -138.95 -132.43 2.95 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.654 -177.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 94.91 102.73 1.83 Allowed Glycine 0 C--N 1.317 -0.52 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 13.3 m -138.96 141.1 38.42 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -90.03 -106.94 1.25 Allowed Glycine 0 C--N 1.308 -0.975 0 N-CA-C 112.005 -0.438 . . . . 0.0 112.005 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . 0.423 ' N ' ' HG2' ' B' ' 138' ' ' GLU . . . 156.17 82.06 0.04 OUTLIER Glycine 0 N--CA 1.434 -1.461 0 C-N-CA 120.22 -0.99 . . . . 0.0 112.98 178.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -119.55 -42.24 0.54 Allowed Glycine 0 C--N 1.311 -0.854 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 27.7 t -146.67 -56.71 0.27 Allowed 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 74.5 mt -106.39 -36.77 6.72 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-O 121.48 0.657 . . . . 0.0 111.564 -177.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.451 ' H ' ' CD ' ' B' ' 138' ' ' GLU . 0.1 OUTLIER -71.23 -10.78 60.33 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -169.274 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 19.8 t -59.39 -58.27 9.35 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -174.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -139.99 72.07 1.39 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.44 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 23.5 ptt? -104.05 -32.26 9.29 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 -173.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.469 ' HA ' ' CG2' ' B' ' 145' ' ' ILE 0.339 38.6 mt-10 -37.19 -47.16 0.76 Allowed 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -168.012 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.6 m -64.26 -52.42 58.78 Favored 'General case' 0 C--O 1.267 1.991 0 CA-C-O 121.705 0.764 . . . . 0.0 110.169 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 46.3 mm -64.53 -51.54 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.098 -176.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.528 ' HA ' ' OH ' ' A' ' 65' ' ' TYR . 10.7 tt -58.76 -43.74 88.63 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.688 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.747 -177.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -61.59 -45.7 93.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.264 0.078 . . . . 0.0 110.852 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 20.8 p -66.54 -32.24 73.47 Favored 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -80.73 -31.36 36.06 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.283 0.563 . . . . 0.0 110.308 179.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 12.8 tp -68.21 -54.66 16.22 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.673 -175.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.497 ' HG2' ' NE2' ' A' ' 76' ' ' GLN . 0.0 OUTLIER -164.92 -175.66 3.85 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 119.732 -0.787 . . . . 0.0 112.093 -171.328 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -131.84 -66.02 0.73 Allowed 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 175.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.407 -2.617 0 N-CA-C 101.048 -3.686 . . . . 0.0 101.048 -179.568 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.5 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.4 m -89.52 124.44 42.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.544 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -86.88 61.94 7.1 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 122.921 1.343 . . . . 0.0 111.2 -176.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HD3' ' NE1' ' A' ' 6' ' ' TRP . 14.3 ptpt -148.0 107.69 3.98 Favored 'General case' 0 C--N 1.286 -2.19 0 CA-C-N 114.108 -1.405 . . . . 0.0 109.21 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.94 -25.9 32.26 Favored Glycine 0 C--O 1.239 0.439 0 CA-C-N 114.783 -1.099 . . . . 0.0 115.11 -172.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.48 ' NE1' ' HD3' ' A' ' 4' ' ' LYS . 67.3 p-90 -66.72 -4.66 9.48 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -64.47 -21.44 66.66 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.07 0.462 . . . . 0.0 111.081 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -89.33 0.14 57.03 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.776 0.798 . . . . 0.0 110.065 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 20.6 m-70 -106.4 6.53 30.46 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.388 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.42 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.3 p -136.02 111.08 11.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 CA-C-N 115.312 -0.858 . . . . 0.0 108.955 -178.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 m -81.72 152.85 26.84 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.834 -175.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -37.96 70.58 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.309 177.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -63.57 -33.88 76.57 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.537 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.0 tm? -70.6 -52.25 22.72 Favored 'General case' 0 CA--C 1.498 -1.02 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -176.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.551 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -65.03 -42.73 94.09 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.843 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.7 t -63.99 -31.26 72.38 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 178.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.538 ' NE2' ' HE2' ' A' ' 21' ' ' LYS . 31.0 t60 -69.66 -40.19 76.59 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.204 0.526 . . . . 0.0 109.714 178.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.703 HD23 HD21 ' A' ' 68' ' ' LEU . 5.5 mp -65.57 -41.34 93.04 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.997 176.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 15' ' ' ARG . 69.8 t -57.13 -49.04 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 123.822 0.849 . . . . 0.0 109.628 174.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -52.28 -52.4 52.98 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.869 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.538 ' HE2' ' NE2' ' A' ' 17' ' ' HIS . 58.0 mttm -63.79 -41.06 98.0 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.805 178.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.536 ' O ' HG22 ' A' ' 26' ' ' ILE . 15.1 mt -50.7 -51.94 44.91 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 123.966 0.791 . . . . 0.0 109.949 176.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.719 HG11 ' HE1' ' A' ' 40' ' ' MET . 72.5 t -56.89 -51.04 73.12 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.697 0 O-C-N 124.206 0.941 . . . . 0.0 111.423 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -54.02 -37.64 64.3 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.508 ' HB1' ' HG2' ' A' ' 76' ' ' GLN . . . -82.17 -46.65 13.5 Favored 'General case' 0 C--O 1.21 -0.997 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 177.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.556 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.51 -22.21 16.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.66 0 CA-C-O 122.051 0.929 . . . . 0.0 110.102 -174.345 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.576 ' CG ' HD22 ' A' ' 43' ' ' LEU . 58.4 m-85 -130.58 84.1 60.08 Favored Pre-proline 0 C--N 1.275 -2.652 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.631 177.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.415 ' HG2' ' HA ' ' B' ' 118' ' ' ASP . 19.8 Cg_endo -59.25 107.01 0.33 Allowed 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.865 1.71 . . . . 0.0 109.874 179.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.2 t -84.42 149.08 54.1 Favored Pre-proline 0 C--N 1.29 -1.993 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.055 -174.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.56 -28.61 14.19 Favored 'Trans proline' 0 C--O 1.243 0.737 0 C-N-CA 122.404 2.069 . . . . 0.0 111.427 175.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -155.7 161.06 30.27 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.243 -177.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.45 ' HA ' HD12 ' A' ' 35' ' ' LEU . 57.0 Cg_endo -78.72 -3.5 13.33 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 121.931 1.754 . . . . 0.0 114.623 -177.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.55 ' O ' ' HG2' ' A' ' 36' ' ' LYS . . . -96.89 -16.97 20.45 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.245 0.545 . . . . 0.0 109.868 177.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.621 ' HA ' ' OD2' ' A' ' 37' ' ' ASP . . . -66.06 -17.02 64.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 122.466 1.127 . . . . 0.0 108.828 173.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 32' ' ' PRO . 55.8 mt -80.81 5.42 16.02 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 113.458 -1.701 . . . . 0.0 111.056 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 15.6 ptpt -133.82 6.19 3.69 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.179 0.514 . . . . 0.0 110.722 173.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.621 ' OD2' ' HA ' ' A' ' 34' ' ' ALA . 69.6 m-20 -85.25 179.71 7.16 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.826 178.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.488 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.4 OUTLIER -59.18 -24.83 63.41 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.307 0.643 . . . . 0.0 111.836 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.638 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 22.6 tpp180 -65.27 -35.65 81.69 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.848 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.1 tpp -59.59 -35.07 73.59 Favored 'General case' 0 C--O 1.191 -1.986 0 CA-C-N 114.715 -1.129 . . . . 0.0 112.693 -177.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 13.9 pt-20 -60.92 -32.92 72.39 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.475 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.426 HD22 HD23 ' A' ' 43' ' ' LEU . 5.5 t30 -78.57 -43.89 25.48 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 121.18 0.514 . . . . 0.0 110.133 178.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 16.5 mt -60.77 -50.95 71.4 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.583 -178.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.848 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.5 p -68.84 -32.95 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.59 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.049 -179.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.13 -46.42 82.68 Favored 'General case' 0 C--O 1.242 0.658 0 CA-C-O 120.759 0.314 . . . . 0.0 110.552 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.8 t80 -61.67 -46.75 88.4 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.044 174.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.73 -37.84 88.16 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 120.319 -0.553 . . . . 0.0 111.543 -176.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 44' ' ' VAL . 91.8 mttt -66.74 -43.1 85.09 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 123.232 0.613 . . . . 0.0 111.501 177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 16.9 pttp -67.27 -37.29 83.2 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.549 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 37.3 t -71.26 -48.0 56.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.153 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.603 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.3 tm-20 -57.55 -48.25 79.81 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 123.428 0.691 . . . . 0.0 109.584 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.41 -35.17 91.31 Favored Glycine 0 C--N 1.332 0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.308 178.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -63.52 -52.51 60.89 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 122.729 0.412 . . . . 0.0 110.273 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.461 ' H ' ' HG2' ' A' ' 54' ' ' MET . 0.0 OUTLIER -67.86 -30.61 70.03 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 177.883 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -62.6 -41.48 99.0 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.164 -1.051 . . . . 0.0 108.164 175.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -78.81 -21.84 47.11 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.862 178.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.5 t -84.48 -29.46 26.01 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-O 121.164 0.507 . . . . 0.0 110.869 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.95 166.67 13.77 Favored 'General case' 0 C--O 1.245 0.84 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -176.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -116.72 6.93 13.35 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.416 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.6 p -157.99 158.34 34.71 Favored 'General case' 0 CA--C 1.475 -1.918 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 173.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.42 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.4 -26.21 61.79 Favored 'General case' 0 C--O 1.2 -1.522 0 C-N-CA 119.017 -1.073 . . . . 0.0 110.926 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -66.18 -45.08 82.13 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -62.14 -46.78 87.49 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.15 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.41 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -65.28 -47.4 76.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.816 -0.175 . . . . 0.0 110.928 -177.335 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -58.96 -46.09 88.9 Favored 'General case' 0 C--O 1.208 -1.11 0 C-N-CA 123.459 0.704 . . . . 0.0 110.091 176.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -64.28 -49.61 71.15 Favored 'General case' 0 C--O 1.213 -0.84 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.445 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.3 pp -68.09 -32.51 72.87 Favored 'General case' 0 C--O 1.255 1.395 0 C-N-CA 120.203 -0.599 . . . . 0.0 111.609 -176.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.703 HD21 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -74.47 -35.05 63.27 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.506 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -62.8 -37.46 86.79 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.535 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -64.3 -44.51 91.4 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.954 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -42.23 79.33 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.859 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 7.0 tt -63.49 -44.14 98.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.564 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.491 ' CD2' ' HB2' ' B' ' 150' ' ' MET . 35.7 t80 -55.3 -54.19 46.69 Favored 'General case' 0 C--O 1.259 1.582 0 C-N-CA 124.97 1.308 . . . . 0.0 110.035 -179.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -65.12 -32.02 73.51 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.597 -178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -67.77 -40.94 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 122.96 0.504 . . . . 0.0 111.189 178.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.542 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 43.2 mt-30 -66.21 -39.56 89.71 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.379 0.609 . . . . 0.0 109.425 -179.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.679 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS 0.267 0.0 OUTLIER -71.86 -27.21 62.72 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 174.134 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.514 ' OE1' HD23 ' B' ' 114' ' ' LEU . 2.2 tm-20 -64.9 -52.21 57.71 Favored 'General case' 0 C--N 1.309 -1.196 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.455 ' HA ' ' CG ' ' A' ' 82' ' ' LYS . 4.7 pp -62.16 -37.03 83.64 Favored 'General case' 0 C--O 1.248 1.015 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.142 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.599 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 12.9 pt-20 -65.93 -44.89 83.76 Favored 'General case' 0 N--CA 1.439 -1.0 0 C-N-CA 119.791 -0.763 . . . . 0.0 110.606 -179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -70.61 -43.34 69.5 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.54 -177.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.566 ' HA ' ' CG ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -62.19 -46.35 89.31 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -177.255 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 25.5 ttm180 -77.0 -32.59 57.31 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 123.359 0.412 . . . . 0.0 110.594 -177.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -70.32 -56.68 6.12 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -177.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.3 t -166.48 89.96 0.4 Allowed 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.566 ' CG ' ' HA ' ' A' ' 82' ' ' LYS . 13.7 ptm180 -179.47 -30.65 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.012 1.725 . . . . 0.0 109.732 169.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.9 mp . . . . . 0 N--CA 1.47 0.55 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 173.856 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.85 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 32.8 t -70.82 -36.16 72.81 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 123.287 0.635 . . . . 0.0 111.026 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 96.4 mmm -91.4 -8.47 47.82 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.83 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 39.9 m -62.98 126.1 26.21 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 42.4 m80 77.75 -33.48 0.18 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.804 1.242 . . . . 0.0 112.447 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -81.5 -17.69 47.73 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.974 0.416 . . . . 0.0 111.027 178.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -88.27 -69.5 1.28 Allowed Glycine 0 N--CA 1.423 -2.178 0 N-CA-C 108.686 -1.766 . . . . 0.0 108.686 173.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -84.35 66.27 9.3 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 122.273 1.035 . . . . 0.0 111.554 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -67.63 -44.41 78.06 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 113.732 -1.576 . . . . 0.0 108.652 177.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 3.4 p -57.92 -38.89 76.71 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.478 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 47.7 tp -58.0 -52.82 63.91 Favored 'General case' 0 C--O 1.247 0.949 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.237 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -72.44 -41.77 65.77 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 123.523 0.515 . . . . 0.0 112.044 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -57.31 -55.45 34.62 Favored 'General case' 0 CA--C 1.498 -1.043 0 CA-C-O 121.534 0.683 . . . . 0.0 109.486 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.514 HD23 ' OE1' ' A' ' 78' ' ' GLU . 26.6 tp -69.62 -26.15 64.29 Favored 'General case' 0 C--O 1.183 -2.433 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.563 -175.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 35.8 tp -70.96 -36.05 72.41 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-N 118.926 0.785 . . . . 0.0 109.995 175.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 31.5 m -64.93 -36.13 83.4 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 16.1 m -76.66 -36.3 57.42 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.972 176.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.415 ' HA ' ' HG2' ' A' ' 28' ' ' PRO . 29.5 t70 -57.67 -36.59 72.11 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 125.327 1.451 . . . . 0.0 110.491 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 22.1 m -63.97 -10.4 21.22 Favored 'General case' 0 CA--C 1.566 1.569 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.598 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 64.8 tp -65.66 -57.65 7.6 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 3.4 p -77.52 -45.49 25.29 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.852 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 76.7 t60 71.95 -56.4 0.64 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.075 1.35 . . . . 0.0 110.582 -176.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 13.9 t -117.53 150.09 39.54 Favored 'General case' 0 N--CA 1.419 -2.016 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 32.7 t70 78.44 128.85 0.05 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 125.388 1.475 . . . . 0.0 111.901 -177.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -157.35 -155.1 7.35 Favored Glycine 0 C--O 1.246 0.892 0 N-CA-C 111.579 -0.608 . . . . 0.0 111.579 -178.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -123.03 174.84 16.51 Favored Glycine 0 N--CA 1.44 -1.055 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.833 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -176.81 91.45 0.08 OUTLIER Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 68.1 m -157.07 173.0 17.66 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -114.93 -130.64 4.9 Favored Glycine 0 N--CA 1.424 -2.107 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 177.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -154.57 -119.48 0.7 Allowed Glycine 0 N--CA 1.424 -2.117 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 162.84 -135.44 3.84 Favored Glycine 0 C--N 1.299 -1.48 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 34.5 p -148.48 103.86 3.45 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -127.89 163.95 21.39 Favored Glycine 0 N--CA 1.433 -1.511 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.866 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 175.73 152.91 9.85 Favored Glycine 0 N--CA 1.434 -1.496 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 178.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 160.32 -54.97 0.33 Allowed Glycine 0 C--N 1.311 -0.845 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.441 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 23.1 t -157.17 147.67 21.25 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.023 -1.843 . . . . 0.0 106.023 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.648 ' O ' ' HB3' ' B' ' 141' ' ' MET . 1.5 pt? -105.85 -58.12 1.95 Allowed 'General case' 0 C--O 1.201 -1.48 0 C-N-CA 120.155 -0.618 . . . . 0.0 112.574 -178.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -83.9 -17.09 41.92 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 -174.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 58.1 m -74.71 -60.34 2.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 120.327 -0.549 . . . . 0.0 109.589 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -145.12 109.39 4.87 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 174.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.648 ' HB3' ' O ' ' B' ' 137' ' ' LEU . 24.4 ptp -102.39 -33.07 9.69 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.254 -172.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.435 ' H ' ' CD ' ' B' ' 142' ' ' GLU . 1.1 mp0 -17.98 -70.28 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 127.524 2.33 . . . . 0.0 115.84 -172.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 50.1 m -72.94 -38.66 66.73 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 120.94 0.4 . . . . 0.0 111.373 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 78.9 mt -65.97 -53.4 38.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.196 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 19.8 tt -65.55 -31.69 54.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.139 -177.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.406 ' HG3' ' HB3' ' B' ' 151' ' ' ASP . 38.8 ttm180 -59.93 -51.22 70.62 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 14.8 p -69.41 -39.33 77.99 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -178.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -80.95 -52.91 6.92 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.506 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 7.3 tt -96.39 -17.77 20.39 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.869 -171.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.491 ' HB2' ' CD2' ' A' ' 73' ' ' TYR . 26.4 ttt 79.72 111.54 0.07 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 122.166 0.984 . . . . 0.0 111.213 -177.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . 0.406 ' HB3' ' HG3' ' B' ' 146' ' ' ARG . 13.8 t70 -110.51 -60.69 1.78 Allowed 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.376 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.075 0 C-N-CA 127.364 2.266 . . . . 0.0 105.1 179.084 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.932 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.6 m -88.62 135.48 25.6 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.224 0 CA-C-N 117.538 0.669 . . . . 0.0 110.116 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -84.68 102.29 12.85 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-O 120.952 0.405 . . . . 0.0 111.725 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.6 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 15.6 ptpt -152.35 88.36 1.36 Allowed 'General case' 0 N--CA 1.422 -1.85 0 CA-C-O 121.98 0.895 . . . . 0.0 111.883 175.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.19 -2.97 10.24 Favored Glycine 0 CA--C 1.508 -0.355 0 CA-C-N 114.197 -1.365 . . . . 0.0 114.907 -175.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.6 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 63.7 p-90 -68.35 -11.83 60.17 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 117.391 0.595 . . . . 0.0 110.771 176.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -60.75 -25.15 66.28 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.237 0.541 . . . . 0.0 110.345 176.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -77.69 -4.51 46.49 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 121.141 0.496 . . . . 0.0 110.64 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.7 m-70 -111.61 10.6 21.15 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-O 121.167 0.508 . . . . 0.0 110.664 -177.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.7 p -138.71 110.39 5.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 CA-C-O 122.043 0.925 . . . . 0.0 109.261 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.9 m -81.3 156.23 25.63 Favored 'General case' 0 C--N 1.293 -1.855 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.031 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -37.96 55.09 Favored 'General case' 0 C--O 1.204 -1.338 0 C-N-CA 124.23 1.012 . . . . 0.0 110.509 176.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -60.54 -38.42 84.43 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.542 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -69.87 -50.0 46.8 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 -176.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.571 ' O ' HG23 ' A' ' 19' ' ' VAL . 0.9 OUTLIER -65.23 -46.39 80.81 Favored 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 114.362 -1.29 . . . . 0.0 112.888 -177.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.8 t -66.4 -26.7 67.37 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.015 0.436 . . . . 0.0 110.03 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.438 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 10.2 t60 -64.8 -49.81 69.23 Favored 'General case' 0 C--O 1.242 0.675 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 176.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.738 HD23 HD21 ' A' ' 68' ' ' LEU . 4.5 mp -63.7 -39.46 94.37 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.197 177.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 15' ' ' ARG . 65.8 t -58.35 -51.85 66.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 124.077 0.951 . . . . 0.0 110.897 175.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -54.28 -45.42 72.47 Favored 'General case' 0 C--O 1.254 1.303 0 C-N-CA 123.705 0.802 . . . . 0.0 110.482 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -66.78 -39.56 87.85 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.162 -0.927 . . . . 0.0 111.901 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.486 ' O ' HG22 ' A' ' 26' ' ' ILE . 30.1 mt -51.14 -50.58 58.62 Favored 'General case' 0 CA--C 1.5 -0.977 0 O-C-N 123.76 0.663 . . . . 0.0 109.963 175.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.541 HG13 ' HB3' ' A' ' 43' ' ' LEU . 73.8 t -54.19 -53.47 28.79 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.89 0 O-C-N 124.285 0.99 . . . . 0.0 110.353 176.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -51.91 -37.41 52.41 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -178.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.16 -46.31 13.95 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 178.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.486 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -75.92 -21.97 15.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 121.856 0.836 . . . . 0.0 110.422 -174.256 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.481 ' CD2' HG23 ' A' ' 26' ' ' ILE . 42.2 m-85 -133.98 89.72 28.51 Favored Pre-proline 0 N--CA 1.412 -2.333 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.412 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -59.76 100.47 0.14 Allowed 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.019 1.813 . . . . 0.0 110.383 176.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -67.84 138.04 92.79 Favored Pre-proline 0 N--CA 1.428 -1.545 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.762 -172.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.511 ' HB3' ' O ' ' B' ' 121' ' ' SER . 18.6 Cg_endo -64.34 -30.38 63.29 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.825 2.35 . . . . 0.0 111.832 178.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.512 ' HB2' ' O ' ' B' ' 124' ' ' ASP . 22.2 t70 -161.79 150.03 12.46 Favored Pre-proline 0 CA--C 1.503 -0.838 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 -176.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.434 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 7.6 Cg_endo -54.73 -25.05 40.44 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 122.579 2.186 . . . . 0.0 113.717 174.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.96 -11.72 59.84 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 121.21 -0.931 . . . . 0.0 112.029 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.69 -9.38 59.8 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.761 0.791 . . . . 0.0 109.258 177.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.434 ' CD1' ' HA ' ' A' ' 32' ' ' PRO . 22.6 mt -87.84 -0.07 56.48 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.711 -178.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.411 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -133.86 15.3 3.94 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.967 0.889 . . . . 0.0 110.205 178.027 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.644 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 30.9 t70 -94.25 179.73 5.21 Favored 'General case' 0 C--N 1.304 -1.398 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.16 -178.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.644 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.7 -25.15 62.83 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 120.591 0.234 . . . . 0.0 110.75 177.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.642 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 15.4 tpp180 -57.87 -34.65 69.98 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 174.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.749 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 13.7 tpp -60.38 -36.98 79.35 Favored 'General case' 0 C--O 1.199 -1.553 0 CA-C-N 114.613 -1.176 . . . . 0.0 113.133 -178.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.8 pt-20 -62.65 -31.43 72.3 Favored 'General case' 0 C--O 1.202 -1.431 0 C-N-CA 118.528 -1.269 . . . . 0.0 110.165 -177.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.481 HD22 HD23 ' A' ' 43' ' ' LEU . 6.3 t30 -74.23 -47.42 35.35 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-O 121.77 0.795 . . . . 0.0 110.099 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 20.4 mt -63.54 -46.46 85.89 Favored 'General case' 0 C--O 1.246 0.917 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.704 -177.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.749 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.2 p -71.86 -27.86 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.534 -178.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.9 -47.6 84.41 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.55 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 4.9 t80 -60.09 -46.26 90.18 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.23 173.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.15 97.83 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.367 -176.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -65.09 -39.36 93.07 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 123.603 0.761 . . . . 0.0 111.629 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.7 pttp -70.96 -38.54 72.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.527 0.68 . . . . 0.0 109.923 -177.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.485 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 42.8 t -73.66 -43.2 54.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.915 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.416 ' HG3' HG23 ' A' ' 19' ' ' VAL . 11.0 tm-20 -59.44 -45.3 91.98 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.88 -41.37 94.14 Favored Glycine 0 C--O 1.221 -0.696 0 O-C-N 123.663 0.602 . . . . 0.0 112.281 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.9 -54.34 48.06 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 123.104 0.562 . . . . 0.0 111.195 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.482 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -67.24 -34.13 76.81 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 178.673 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -62.37 -43.37 98.98 Favored 'General case' 0 C--O 1.2 -1.521 0 C-N-CA 123.754 0.822 . . . . 0.0 109.083 176.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -81.6 -15.29 55.17 Favored 'General case' 0 C--N 1.311 -1.076 0 O-C-N 121.414 -0.804 . . . . 0.0 112.035 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.5 t -85.43 -44.37 12.8 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 122.264 -0.273 . . . . 0.0 111.716 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.94 163.63 24.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 113.647 0.981 . . . . 0.0 113.647 -175.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -105.59 -2.42 23.52 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.686 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.2 m -153.5 157.71 40.23 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.483 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -71.8 -34.75 69.62 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 119.885 -0.726 . . . . 0.0 111.113 177.774 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -62.06 -39.28 91.86 Favored 'General case' 0 C--O 1.205 -1.245 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 175.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -65.35 -48.48 72.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.535 177.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -44.96 92.35 Favored 'General case' 0 N--CA 1.434 -1.256 0 O-C-N 123.434 0.459 . . . . 0.0 110.197 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -60.53 -44.76 95.72 Favored 'General case' 0 C--O 1.208 -1.088 0 O-C-N 123.829 0.706 . . . . 0.0 110.249 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -58.8 -55.78 30.64 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.326 0.65 . . . . 0.0 111.03 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.482 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.5 pp -67.4 -33.72 75.76 Favored 'General case' 0 C--O 1.249 1.061 0 CA-C-O 121.058 0.456 . . . . 0.0 112.096 -175.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.738 HD21 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -74.98 -32.39 61.67 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.471 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.44 -39.54 94.75 Favored 'General case' 0 C--O 1.21 -1.001 0 CA-C-N 115.296 -0.866 . . . . 0.0 109.573 176.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -63.43 -46.22 87.32 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.903 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.492 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -69.01 -40.75 78.51 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.746 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.524 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 4.1 tt -65.13 -44.83 95.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.285 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -56.54 -49.59 74.35 Favored 'General case' 0 C--O 1.264 1.817 0 C-N-CA 124.823 1.249 . . . . 0.0 110.876 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -66.76 -33.25 75.21 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.898 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.492 HD13 ' O ' ' A' ' 71' ' ' LYS . 1.5 mp -64.29 -39.58 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 176.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.524 ' HG3' ' O ' ' A' ' 72' ' ' ILE . 34.0 mt-30 -63.15 -46.03 89.12 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.294 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.591 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -68.83 -31.04 69.74 Favored 'General case' 0 C--N 1.311 -1.108 0 C-N-CA 118.901 -1.12 . . . . 0.0 113.507 177.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.5 tp10 -61.2 -52.33 65.26 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.509 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -61.46 -43.59 98.6 Favored 'General case' 0 C--O 1.243 0.734 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -177.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.499 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 11.4 pt-20 -69.7 -44.03 71.22 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 119.697 -0.801 . . . . 0.0 112.358 -177.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -73.47 -32.91 64.58 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.504 -178.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.591 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -66.49 -40.54 89.33 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.22 179.214 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.591 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 19.9 tpp180 -77.93 -25.1 48.14 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.912 -178.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 32.9 ttm180 -95.01 -58.55 2.12 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.2 m -160.39 102.02 1.38 Allowed 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -172.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.489 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 3.2 ptp180 -164.6 -33.2 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 123.198 0.599 . . . . 0.0 110.636 168.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.441 ' HG ' ' HG3' ' A' ' 86' ' ' ARG . 49.3 mt . . . . . 0 C--O 1.246 0.921 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -178.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.063 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 15.0 m -73.3 112.3 9.24 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 14.5 tpt -79.28 -30.1 42.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.564 0.697 . . . . 0.0 109.55 -177.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . 0.51 ' HB3' ' H ' ' B' ' 108' ' ' ASN . 27.3 m -93.39 100.4 12.72 Favored 'General case' 0 N--CA 1.418 -2.027 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.427 177.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -84.99 101.41 12.35 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 65.65 -0.02 1.35 Allowed 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 114.865 1.431 . . . . 0.0 114.865 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.32 -81.89 0.83 Allowed Glycine 0 N--CA 1.429 -1.772 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 175.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.51 ' H ' ' HB3' ' B' ' 104' ' ' SER . 94.7 m-20 -98.8 79.99 2.47 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 121.774 0.797 . . . . 0.0 112.067 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -83.57 -42.71 16.48 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.635 -1.166 . . . . 0.0 110.345 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 28.7 m -59.51 -47.19 86.49 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-N 114.527 -1.215 . . . . 0.0 111.358 -176.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 63.4 tp -54.15 -50.92 65.87 Favored 'General case' 0 C--O 1.21 -0.98 0 O-C-N 123.897 0.748 . . . . 0.0 111.77 -178.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -71.61 -41.15 69.26 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -174.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.01 -40.54 65.1 Favored 'General case' 0 C--O 1.246 0.873 0 C-N-CA 119.717 -0.793 . . . . 0.0 110.449 -178.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.509 HD21 ' HB3' ' A' ' 79' ' ' LEU . 42.9 tp -72.34 -23.08 61.09 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.412 178.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.8 tp -66.43 -41.39 89.28 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 172.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 28.7 m -58.96 -41.93 88.69 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 22.2 m -66.66 -41.11 88.69 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-O 121.301 0.572 . . . . 0.0 111.154 175.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.3 -31.77 72.41 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.26 1.024 . . . . 0.0 110.347 178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 19.8 m -77.25 -16.65 58.93 Favored 'General case' 0 C--N 1.304 -1.388 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.628 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.484 HD23 ' O ' ' B' ' 120' ' ' LEU . 6.8 tt -87.26 -21.98 25.46 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . 0.511 ' O ' ' HB3' ' A' ' 30' ' ' PRO . 9.4 t -57.8 -57.82 11.1 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.974 -175.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 63.5 m80 67.28 -48.08 0.49 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.332 1.053 . . . . 0.0 113.817 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 32.7 m 77.34 95.63 0.06 Allowed 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.181 1.793 . . . . 0.0 109.209 -174.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.512 ' O ' ' HB2' ' A' ' 31' ' ' ASP . 19.9 t70 -148.14 128.59 13.99 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 -176.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -97.84 147.4 18.59 Favored Glycine 0 C--N 1.306 -1.096 0 N-CA-C 115.259 0.864 . . . . 0.0 115.259 -171.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -140.3 -52.99 0.04 OUTLIER Glycine 0 C--N 1.3 -1.465 0 N-CA-C 108.837 -1.705 . . . . 0.0 108.837 177.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 96.96 122.98 4.41 Favored Glycine 0 N--CA 1.427 -1.904 0 N-CA-C 114.259 0.463 . . . . 0.0 114.259 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 62.4 m -163.33 169.28 19.3 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 124.467 1.107 . . . . 0.0 110.002 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -92.4 -118.03 2.45 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 110.927 -0.869 . . . . 0.0 110.927 177.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.13 145.31 6.84 Favored Glycine 0 C--N 1.306 -1.134 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -178.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -144.97 144.08 12.72 Favored Glycine 0 C--N 1.306 -1.119 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.036 -178.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 33.7 m -134.01 114.32 13.09 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -160.08 169.19 35.93 Favored Glycine 0 N--CA 1.432 -1.617 0 N-CA-C 110.364 -1.095 . . . . 0.0 110.364 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . 0.471 ' C ' ' HG2' ' B' ' 138' ' ' GLU . . . 89.53 162.13 38.13 Favored Glycine 0 N--CA 1.432 -1.571 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . 0.451 ' N ' ' HG2' ' B' ' 138' ' ' GLU . . . 141.46 -129.71 4.12 Favored Glycine 0 N--CA 1.417 -2.602 0 C-N-CA 120.577 -0.821 . . . . 0.0 111.995 179.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 5.1 m -139.57 -50.74 0.51 Allowed 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 122.018 0.913 . . . . 0.0 109.076 -177.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 40.0 mt -79.99 -13.82 59.04 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.663 1.185 . . . . 0.0 110.059 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.561 ' HA ' ' SD ' ' B' ' 141' ' ' MET . 0.0 OUTLIER -56.0 -13.06 1.69 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 116.891 2.182 . . . . 0.0 116.891 -172.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 54.8 m -49.39 -51.34 35.57 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 123.384 0.674 . . . . 0.0 112.086 -175.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -154.43 74.58 0.96 Allowed 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 172.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.561 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 24.4 ptm -101.96 -21.26 14.54 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 114.667 -1.151 . . . . 0.0 112.481 -175.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.425 ' HA ' HG22 ' B' ' 145' ' ' ILE . 22.0 mm-40 -37.89 -54.9 1.25 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 117.405 2.372 . . . . 0.0 117.405 -175.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 16.2 t -71.26 -30.81 66.75 Favored 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 119.749 -0.781 . . . . 0.0 110.317 -177.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 49.1 mm -74.82 -44.5 45.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.708 -179.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.425 HG22 ' HA ' ' B' ' 142' ' ' GLU . 18.5 tt -69.11 -31.32 49.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 CA-C-O 120.754 0.312 . . . . 0.0 110.248 -179.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.483 ' HD3' ' O ' ' B' ' 150' ' ' MET . 4.0 tpp180 -63.4 -61.51 2.3 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 173.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 40.3 t -55.01 -53.76 51.66 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.575 -177.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -81.93 -46.1 14.5 Favored 'General case' 0 C--N 1.307 -1.243 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -172.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 72' ' ' ILE . 10.4 tt -93.17 -34.67 13.52 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -169.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.483 ' O ' ' HD3' ' B' ' 146' ' ' ARG . 26.1 ptm -169.95 110.07 0.41 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 118.561 -1.256 . . . . 0.0 113.253 -174.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -87.56 151.26 23.13 Favored 'General case' 0 C--N 1.285 -2.216 0 CA-C-N 114.465 -1.243 . . . . 0.0 109.875 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.249 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 -179.152 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.832 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 33.8 m -132.95 152.89 36.85 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.697 0 CA-C-O 121.736 0.779 . . . . 0.0 112.264 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.513 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -114.76 102.52 10.09 Favored 'General case' 0 N--CA 1.413 -2.307 0 N-CA-C 103.183 -2.895 . . . . 0.0 103.183 170.405 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.432 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 13.4 ptpt -84.22 99.48 10.57 Favored 'General case' 0 C--N 1.286 -2.194 0 C-N-CA 119.66 -0.816 . . . . 0.0 113.022 -171.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.45 -14.59 28.18 Favored Glycine 0 C--O 1.238 0.367 0 CA-C-N 113.762 -1.563 . . . . 0.0 115.079 -175.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.534 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 69.4 p-90 -73.69 -3.01 25.65 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 122.242 -0.564 . . . . 0.0 111.992 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -62.91 -24.0 67.63 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 121.153 0.502 . . . . 0.0 110.971 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -79.19 -20.75 47.61 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.572 0.701 . . . . 0.0 109.786 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.534 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 13.4 m-70 -90.29 2.84 55.07 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.649 -1.159 . . . . 0.0 110.116 -174.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.483 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.4 p -132.64 123.86 50.09 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.774 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 m -87.81 154.4 20.57 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.874 -175.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.5 -43.25 75.47 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 172.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -62.08 -32.59 73.15 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.499 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.501 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.24 -52.15 15.07 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 -177.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.541 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.4 ptm180 -63.79 -42.74 97.67 Favored 'General case' 0 N--CA 1.425 -1.698 0 CA-C-N 114.618 -1.174 . . . . 0.0 112.844 -178.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.1 t -65.66 -33.53 76.1 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.242 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -64.24 -44.41 91.91 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.757 HD23 HD21 ' A' ' 68' ' ' LEU . 4.8 mp -64.82 -39.45 93.61 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.235 178.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 15' ' ' ARG . 65.1 t -58.32 -51.04 76.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.512 0.725 . . . . 0.0 110.01 174.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.423 ' O ' ' HG3' ' A' ' 24' ' ' GLN . 16.4 t-80 -51.98 -47.27 64.92 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 124.23 1.012 . . . . 0.0 110.503 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.622 ' HD3' HD22 ' B' ' 149' ' ' LEU . 40.3 mttm -68.71 -41.14 79.52 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.593 178.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.476 ' O ' HG22 ' A' ' 26' ' ' ILE . 31.6 mt -51.32 -50.27 59.73 Favored 'General case' 0 CA--C 1.501 -0.923 0 O-C-N 123.931 0.769 . . . . 0.0 109.743 175.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 43' ' ' LEU . 46.2 t -53.69 -53.78 23.74 Favored 'Isoleucine or valine' 0 C--O 1.18 -2.577 0 O-C-N 124.549 1.155 . . . . 0.0 110.199 175.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.423 ' HG3' ' O ' ' A' ' 20' ' ' HIS . 97.9 mt-30 -51.14 -39.38 56.14 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -177.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.43 ' HB3' HG13 ' A' ' 72' ' ' ILE . . . -81.71 -46.35 14.4 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.504 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -75.03 -23.8 17.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.881 0.848 . . . . 0.0 109.674 -174.637 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.538 ' CG ' HD22 ' A' ' 43' ' ' LEU . 50.6 m-85 -136.65 87.99 20.01 Favored Pre-proline 0 N--CA 1.408 -2.558 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.014 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.467 ' O ' ' HB2' ' B' ' 121' ' ' SER . 9.6 Cg_endo -55.56 113.36 1.39 Allowed 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 121.583 1.522 . . . . 0.0 109.426 174.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 t -77.1 137.23 65.31 Favored Pre-proline 0 N--CA 1.42 -1.971 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.725 -176.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.573 ' HA ' ' O ' ' B' ' 123' ' ' SER . 71.6 Cg_endo -73.43 -25.72 15.01 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.937 2.424 . . . . 0.0 111.814 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -151.97 144.41 16.74 Favored Pre-proline 0 CA--C 1.497 -1.087 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -177.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -60.25 -22.96 72.59 Favored 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.115 1.876 . . . . 0.0 113.131 175.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.55 -3.26 57.51 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 121.348 -0.845 . . . . 0.0 111.095 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -80.15 -9.94 59.74 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 173.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.46 ' HA ' ' CE ' ' A' ' 40' ' ' MET . 20.2 mt -88.44 6.75 36.09 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.611 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -136.06 12.28 3.34 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-O 121.937 0.875 . . . . 0.0 109.159 173.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.692 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 23.1 t70 -91.83 -179.82 5.42 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 114.416 -1.265 . . . . 0.0 110.614 -170.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.692 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.66 -26.86 62.71 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-O 121.02 0.438 . . . . 0.0 110.526 175.608 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.677 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -66.23 -30.07 70.44 Favored 'General case' 0 C--O 1.247 0.932 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 174.696 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.569 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.98 -40.85 90.51 Favored 'General case' 0 C--O 1.193 -1.884 0 CA-C-O 118.476 -0.773 . . . . 0.0 110.976 -179.004 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.2 pt-20 -61.49 -31.8 71.8 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.507 -174.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.509 HD22 HD23 ' A' ' 43' ' ' LEU . 5.5 t30 -75.68 -43.23 48.38 Favored 'General case' 0 C--O 1.262 1.76 0 CA-C-O 121.479 0.656 . . . . 0.0 110.57 176.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.677 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 17.9 mt -64.14 -47.29 80.52 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.261 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 40' ' ' MET . 27.7 m -69.37 -30.63 46.43 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.05 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.082 178.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.26 -50.42 69.54 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 175.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.565 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.1 t80 -59.68 -48.37 81.95 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.444 174.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.69 -38.39 87.65 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 120.552 -0.459 . . . . 0.0 112.085 -175.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.07 -45.81 76.2 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 123.036 0.535 . . . . 0.0 110.665 177.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -64.03 -38.14 89.98 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.485 0.66 . . . . 0.0 110.139 -177.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.489 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 50.0 t -73.1 -44.07 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.069 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.836 179.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -58.3 -45.63 87.62 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 177.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.76 -42.24 97.92 Favored Glycine 0 CA--C 1.503 -0.714 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.153 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.438 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 27.0 t70 -55.06 -54.37 43.93 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 123.026 0.53 . . . . 0.0 111.26 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.645 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -70.39 -30.35 67.23 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -179.611 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -62.32 -48.51 79.52 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 176.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -73.74 -24.24 59.87 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.519 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -75.03 -31.93 61.45 Favored 'General case' 0 C--N 1.296 -1.721 0 CA-C-O 121.417 0.627 . . . . 0.0 110.037 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -90.56 167.09 12.83 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 121.683 0.754 . . . . 0.0 112.977 -175.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.418 HD22 ' C ' ' A' ' 59' ' ' ASN . 0.3 OUTLIER -118.5 11.35 12.9 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.97 -179.86 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 24.3 p -164.76 156.22 15.27 Favored 'General case' 0 N--CA 1.421 -1.917 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.483 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.0 OUTLIER -72.14 -28.16 63.08 Favored 'General case' 0 C--O 1.202 -1.404 0 C-N-CA 119.447 -0.901 . . . . 0.0 111.065 179.756 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -61.34 -47.79 84.26 Favored 'General case' 0 C--O 1.211 -0.925 0 O-C-N 123.66 0.6 . . . . 0.0 109.581 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 5.1 tp10 -60.93 -48.97 79.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.257 177.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -46.41 81.99 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.031 -175.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -62.66 -41.23 98.95 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 123.542 0.526 . . . . 0.0 109.742 176.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 -60.05 -57.54 12.39 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.131 0.572 . . . . 0.0 112.244 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.645 HD11 ' HB2' ' A' ' 54' ' ' MET . 3.6 pp -66.57 -32.08 73.19 Favored 'General case' 0 C--O 1.252 1.206 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -174.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.757 HD21 HD23 ' A' ' 18' ' ' LEU . 1.0 OUTLIER -75.86 -31.42 59.27 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.44 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.481 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -65.2 -34.39 78.26 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.77 175.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -68.82 -44.36 73.66 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.393 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.1 -39.08 86.65 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.174 179.645 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.482 ' O ' ' HG3' ' A' ' 76' ' ' GLN . 7.2 tt -66.54 -44.3 90.25 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.47 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.224 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.452 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 54.4 t80 -55.36 -51.64 66.14 Favored 'General case' 0 C--O 1.255 1.386 0 C-N-CA 124.741 1.217 . . . . 0.0 111.022 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.87 -34.64 78.88 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.676 -178.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.15 -38.53 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.897 178.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.527 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 33.4 mt-30 -66.69 -41.57 87.84 Favored 'General case' 0 CA--C 1.509 -0.611 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.075 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.54 ' HA ' ' HG2' ' A' ' 80' ' ' GLU . 0.6 OUTLIER -71.7 -28.27 63.59 Favored 'General case' 0 N--CA 1.424 -1.741 0 C-N-CA 118.936 -1.106 . . . . 0.0 113.541 176.199 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -66.57 -42.3 87.26 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.594 ' O ' ' HB2' ' A' ' 83' ' ' ARG . 4.6 pp -65.83 -46.09 79.83 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.957 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 16.9 pt-20 -68.93 -35.36 76.71 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 119.246 -0.981 . . . . 0.0 111.904 -177.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.9 pt-20 -68.53 -42.08 78.98 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 120.039 -0.665 . . . . 0.0 111.168 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.613 ' HD3' ' N ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -70.02 -33.66 72.28 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.494 0.664 . . . . 0.0 110.761 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.613 ' N ' ' HD3' ' A' ' 82' ' ' LYS . 26.5 ttt180 -77.56 -34.38 53.74 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.945 -172.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 59.3 ttt180 -108.05 -59.0 1.91 Allowed 'General case' 0 N--CA 1.438 -1.073 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 73.7 m -157.88 92.12 1.17 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -171.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.409 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 15.9 ptm180 -142.15 -21.59 0.7 Allowed 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.889 165.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.243 0.742 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 171.072 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.83 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 30.9 t -73.53 -31.7 63.81 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -70.05 -23.13 63.04 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.406 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 8.5 t -89.11 79.33 7.22 Favored 'General case' 0 N--CA 1.418 -2.026 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -74.66 -22.52 58.84 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 113.935 -1.484 . . . . 0.0 111.718 -176.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 58.58 84.24 0.11 Allowed 'General case' 0 C--O 1.24 0.579 0 CA-C-O 122.656 1.217 . . . . 0.0 112.243 -174.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 142.9 -44.88 0.94 Allowed Glycine 0 N--CA 1.416 -2.672 0 CA-C-N 112.721 -2.036 . . . . 0.0 108.671 -175.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -112.95 14.25 19.68 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -73.29 -11.86 60.65 Favored 'General case' 0 N--CA 1.483 1.194 0 O-C-N 121.41 -0.806 . . . . 0.0 110.154 179.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 25.6 p -59.01 -28.75 66.68 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.31 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 37.4 tp -56.23 -58.02 9.72 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.83 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.471 ' HA ' ' HB3' ' B' ' 115' ' ' LEU . 20.5 pt20 -76.01 -25.26 55.54 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.677 -177.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.08 -47.62 79.39 Favored 'General case' 0 C--O 1.254 1.293 0 CA-C-O 122.087 0.946 . . . . 0.0 108.968 175.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.52 HD21 ' HB3' ' A' ' 79' ' ' LEU . 26.3 tp -71.94 -27.34 62.73 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.41 178.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.598 HD23 ' NZ ' ' A' ' 82' ' ' LYS . 2.9 tm? -67.43 -35.93 80.22 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 172.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 47.0 m -62.7 -37.43 86.44 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 177.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.518 ' O ' ' HG ' ' B' ' 120' ' ' LEU . 13.3 m -66.58 -49.54 66.05 Favored 'General case' 0 CA--C 1.557 1.219 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.509 173.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -55.67 -36.52 67.19 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.251 1.021 . . . . 0.0 111.149 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 41.7 m -66.25 -18.3 65.27 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.671 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' B' ' 117' ' ' SER . 3.2 pp -95.57 -20.93 18.59 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.314 -0.954 . . . . 0.0 110.129 175.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 28' ' ' PRO . 32.5 t -77.33 -60.78 2.22 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.799 -177.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 58.72 -69.74 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 124.368 1.067 . . . . 0.0 110.617 -169.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . 0.573 ' O ' ' HA ' ' A' ' 30' ' ' PRO . 42.5 m -101.05 150.56 22.78 Favored 'General case' 0 N--CA 1.427 -1.616 0 C-N-CA 124.352 1.061 . . . . 0.0 108.674 -179.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -99.67 128.05 45.77 Favored 'General case' 0 CA--C 1.493 -1.217 0 CA-C-O 120.827 0.346 . . . . 0.0 110.864 -176.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -88.16 -19.21 53.83 Favored Glycine 0 N--CA 1.438 -1.193 0 C-N-CA 120.894 -0.669 . . . . 0.0 111.76 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 76.08 -157.95 49.02 Favored Glycine 0 N--CA 1.443 -0.887 0 N-CA-C 111.251 -0.739 . . . . 0.0 111.251 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 148.91 86.87 0.06 OUTLIER Glycine 0 N--CA 1.436 -1.333 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.628 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 36.5 m -69.01 122.59 19.0 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 120.795 0.331 . . . . 0.0 110.108 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -114.77 108.79 2.02 Favored Glycine 0 N--CA 1.43 -1.76 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.016 -178.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -162.45 -127.61 0.89 Allowed Glycine 0 N--CA 1.433 -1.521 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 76.81 -142.78 28.16 Favored Glycine 0 N--CA 1.431 -1.694 0 C-N-CA 120.778 -0.725 . . . . 0.0 111.407 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 11.6 p -153.99 126.48 8.05 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 -178.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . 0.548 ' HA3' ' HG2' ' B' ' 138' ' ' GLU . . . -85.44 -69.89 1.34 Allowed Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.029 -1.082 . . . . 0.0 111.61 178.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 118.19 56.73 0.28 Allowed Glycine 0 C--O 1.248 1.018 0 C-N-CA 120.046 -1.073 . . . . 0.0 112.548 176.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -145.39 -46.89 0.04 OUTLIER Glycine 0 N--CA 1.425 -2.09 0 C-N-CA 121.497 -0.382 . . . . 0.0 112.492 178.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 29.3 p -161.02 -80.29 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.419 ' O ' ' HG3' ' B' ' 141' ' ' MET . 67.6 mt -92.2 -37.02 12.94 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.383 0.611 . . . . 0.0 111.22 -174.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.548 ' HG2' ' HA3' ' B' ' 133' ' ' GLY . 0.0 OUTLIER -67.23 -12.95 61.44 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -170.274 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 37.6 t -73.72 -36.63 65.23 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.746 -178.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -135.87 70.12 1.43 Allowed 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.59 0.709 . . . . 0.0 110.841 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.512 ' HB3' ' HB ' ' B' ' 145' ' ' ILE . 63.6 mtm -103.32 -55.17 2.45 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.491 177.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 8.57 -73.63 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 127.651 2.381 . . . . 0.0 117.147 -174.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 7.0 p -70.56 -44.76 66.77 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-O 121.544 0.688 . . . . 0.0 111.618 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 69.7 mt -62.32 -53.63 44.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.228 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.512 ' HB ' ' HB3' ' B' ' 141' ' ' MET . 16.2 tt -64.66 -31.3 53.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.822 -176.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.419 ' O ' ' HA ' ' B' ' 150' ' ' MET . 29.6 ttt180 -63.36 -54.44 36.92 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 39.0 t -67.09 -41.75 85.8 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.222 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -79.55 -53.91 6.41 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -174.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.622 HD22 ' HD3' ' A' ' 21' ' ' LYS . 10.2 tt -98.72 -10.05 23.7 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -175.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.484 ' SD ' ' HB2' ' A' ' 76' ' ' GLN . 23.8 ttt 81.53 151.37 0.1 Allowed 'General case' 0 C--O 1.251 1.182 0 CA-C-O 121.9 0.857 . . . . 0.0 112.577 173.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -146.22 -171.6 3.76 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 107.24 -1.392 . . . . 0.0 107.24 -175.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.312 -1.032 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -178.064 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.034 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.5 m -108.3 129.65 62.26 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-N 117.339 0.57 . . . . 0.0 110.526 178.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -104.55 88.98 3.07 Favored 'General case' 0 C--N 1.297 -1.701 0 CA-C-O 121.854 0.835 . . . . 0.0 111.873 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -138.96 106.21 5.5 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 113.861 -1.518 . . . . 0.0 108.893 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.46 -14.35 8.99 Favored Glycine 0 N--CA 1.475 1.282 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 -170.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.2 p-90 -73.02 -11.69 60.65 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 117.535 0.667 . . . . 0.0 111.835 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.45 -18.39 50.98 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 121.248 0.547 . . . . 0.0 111.691 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -75.73 -21.73 57.23 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.301 0.572 . . . . 0.0 110.448 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -101.92 14.29 32.37 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.353 0.597 . . . . 0.0 111.631 -174.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.429 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 4.1 p -135.11 110.63 12.54 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.229 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.12 165.72 12.1 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.151 -0.931 . . . . 0.0 113.337 -176.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -36.13 76.21 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.669 -176.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -71.8 -33.21 68.37 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.03 -0.668 . . . . 0.0 111.888 -176.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.547 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -66.81 -50.52 62.37 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.51 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.3 ptm180 -67.92 -42.91 80.35 Favored 'General case' 0 N--CA 1.413 -2.279 0 CA-C-N 114.291 -1.322 . . . . 0.0 112.433 -177.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.1 t -63.96 -26.99 68.83 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.197 0.523 . . . . 0.0 110.277 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 8.5 t60 -65.62 -52.63 50.48 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 175.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.772 HD23 HD21 ' A' ' 68' ' ' LEU . 4.4 mp -61.39 -42.66 99.08 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.356 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 15' ' ' ARG . 51.5 t -55.92 -50.32 69.74 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 C-N-CA 124.442 1.097 . . . . 0.0 110.487 175.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -55.33 -42.63 74.06 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 123.833 0.853 . . . . 0.0 110.477 178.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 46.6 mttm -69.58 -36.54 76.35 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.317 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 19' ' ' VAL . 83.5 mt -57.01 -42.1 79.7 Favored 'General case' 0 CA--C 1.518 -0.268 0 O-C-N 123.286 0.366 . . . . 0.0 110.022 175.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.487 HG11 ' HE1' ' A' ' 40' ' ' MET . 55.7 t -56.88 -52.84 50.12 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.148 0 O-C-N 124.22 0.95 . . . . 0.0 110.533 171.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -54.65 -33.54 60.8 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.453 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.0 -43.95 18.84 Favored 'General case' 0 C--O 1.206 -1.195 0 CA-C-O 121.16 0.505 . . . . 0.0 111.856 177.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.451 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.6 tt -73.72 -31.42 31.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 O-C-N 120.952 -1.092 . . . . 0.0 110.885 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.404 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 17.9 m-85 -132.07 95.44 21.86 Favored Pre-proline 0 C--N 1.264 -3.144 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.176 -176.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 18.7 Cg_endo -63.89 94.14 0.19 Allowed 'Trans proline' 0 C--N 1.358 1.034 0 C-N-CA 122.219 1.946 . . . . 0.0 110.556 177.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.411 ' OG1' ' HB3' ' A' ' 34' ' ' ALA . 14.6 t -62.94 132.56 95.01 Favored Pre-proline 0 N--CA 1.426 -1.649 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.383 -175.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.542 ' HA ' ' HA3' ' B' ' 125' ' ' GLY . 29.8 Cg_endo -67.51 -33.14 29.88 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.7 2.267 . . . . 0.0 111.791 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -150.9 147.65 21.31 Favored Pre-proline 0 C--N 1.306 -1.289 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 -177.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -56.29 -17.87 22.3 Favored 'Trans proline' 0 CA--C 1.553 1.425 0 C-N-CA 122.507 2.138 . . . . 0.0 113.596 174.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.33 -6.02 59.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.696 -0.627 . . . . 0.0 112.193 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.411 ' HB3' ' OG1' ' A' ' 29' ' ' THR . . . -81.84 -11.35 58.99 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 122.138 0.971 . . . . 0.0 108.8 175.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.463 ' O ' ' HG2' ' A' ' 40' ' ' MET . 33.8 mt -84.91 4.51 33.11 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.233 -1.348 . . . . 0.0 110.472 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -133.22 17.36 4.08 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-O 121.863 0.84 . . . . 0.0 109.856 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.584 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 37.2 t70 -92.02 177.11 6.27 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.827 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.81 -26.84 63.48 Favored 'General case' 0 C--N 1.307 -1.248 0 O-C-N 122.28 -0.262 . . . . 0.0 110.409 176.478 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.581 ' O ' HD13 ' A' ' 43' ' ' LEU . 39.8 ttm180 -60.08 -35.81 76.0 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.719 0.771 . . . . 0.0 109.558 175.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.61 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.8 tpp -57.83 -32.27 67.44 Favored 'General case' 0 C--O 1.2 -1.509 0 CA-C-N 114.603 -1.18 . . . . 0.0 112.228 178.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 13.5 pt-20 -64.28 -32.37 73.93 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 118.551 -1.26 . . . . 0.0 110.299 -178.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.475 HD22 HD12 ' A' ' 43' ' ' LEU . 1.7 t30 -72.6 -45.28 59.84 Favored 'General case' 0 C--O 1.253 1.27 0 CA-C-O 122.277 1.037 . . . . 0.0 109.139 176.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.581 HD13 ' O ' ' A' ' 39' ' ' ARG . 3.0 mp -55.7 -56.33 21.76 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 113.551 -1.659 . . . . 0.0 110.165 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.61 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 2.7 p -70.28 -27.55 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.858 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.176 -176.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.6 -49.36 76.67 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 176.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.526 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.1 t80 -62.21 -45.55 92.85 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.083 175.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.22 -45.99 83.34 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.915 -177.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -63.88 -43.84 94.84 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 124.055 0.942 . . . . 0.0 112.857 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 59.1 pttt -64.09 -41.05 97.44 Favored 'General case' 0 C--O 1.251 1.163 0 CA-C-O 121.582 0.706 . . . . 0.0 110.175 -177.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.479 HG21 ' CE2' ' A' ' 46' ' ' TYR . 55.9 t -73.1 -45.04 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.163 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.415 ' HG3' HG23 ' A' ' 19' ' ' VAL . 14.9 tm-20 -58.06 -45.25 87.37 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 177.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.25 -43.15 93.7 Favored Glycine 0 N--CA 1.438 -1.203 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.111 178.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -58.53 -54.12 50.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.661 0.267 . . . . 0.0 111.495 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.432 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -65.77 -31.43 72.4 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 179.665 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -65.05 -38.74 91.83 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -82.09 -23.25 35.85 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 121.747 -0.596 . . . . 0.0 112.063 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.3 t -80.22 -40.95 26.1 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 123.047 0.539 . . . . 0.0 111.473 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.17 161.09 29.1 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -106.12 7.4 31.68 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.829 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.5 p -159.11 157.9 31.88 Favored 'General case' 0 CA--C 1.477 -1.849 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.437 ' HG2' HD11 ' B' ' 137' ' ' LEU . 0.2 OUTLIER -72.48 -24.43 61.18 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 119.066 -1.053 . . . . 0.0 109.614 178.184 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -67.57 -47.48 69.66 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 115.088 -0.96 . . . . 0.0 108.499 177.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -60.36 -46.59 89.39 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.496 175.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -46.4 85.87 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 123.319 0.387 . . . . 0.0 110.631 -177.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.402 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 2.9 t80 -62.0 -44.67 96.24 Favored 'General case' 0 C--O 1.216 -0.707 0 O-C-N 123.643 0.59 . . . . 0.0 110.679 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -67.7 -43.13 80.85 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.432 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.3 pp -71.69 -35.18 70.17 Favored 'General case' 0 C--O 1.25 1.079 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.123 -177.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.772 HD21 HD23 ' A' ' 18' ' ' LEU . 1.3 pp -72.26 -33.68 67.67 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.551 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.51 -39.63 94.93 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.03 176.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -62.15 -49.47 75.73 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.433 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.48 -34.55 72.51 Favored 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.042 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.56 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 4.9 tt -70.88 -45.85 71.13 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.563 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -55.15 -50.75 68.48 Favored 'General case' 0 C--O 1.282 2.798 0 C-N-CA 124.665 1.186 . . . . 0.0 110.887 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -62.98 -39.5 94.91 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.629 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.453 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.3 mp -62.44 -39.92 86.14 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.981 0 O-C-N 123.356 0.41 . . . . 0.0 111.861 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.631 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 22.1 mm-40 -57.75 -49.67 75.81 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 121.87 0.843 . . . . 0.0 109.637 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.496 ' H ' ' HG2' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -70.45 -38.21 74.44 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.661 0.985 . . . . 0.0 113.661 178.076 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -59.33 -45.53 91.1 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 3.7 pp -64.25 -42.82 96.33 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.489 -177.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.462 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 4.7 mm-40 -68.9 -41.44 78.25 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -70.47 -35.03 73.06 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 119.464 -0.894 . . . . 0.0 111.438 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.53 -29.87 62.74 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.549 0.69 . . . . 0.0 109.788 178.009 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 4.9 tmm_? -76.96 -32.1 57.05 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.01 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.505 ' O ' ' HB2' ' A' ' 85' ' ' SER . 25.8 tpt180 -75.09 -59.29 2.81 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.364 174.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.505 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 20.4 t 158.1 111.81 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.302 1.441 . . . . 0.0 108.171 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.503 ' HG3' HD22 ' A' ' 87' ' ' LEU . 12.3 ptm180 -124.33 -19.97 5.35 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.776 172.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.503 HD22 ' HG3' ' A' ' 86' ' ' ARG . 4.3 mm? . . . . . 0 C--O 1.247 0.942 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 174.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 110.453 -1.059 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 17.3 t -114.87 104.62 12.11 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 117.493 0.647 . . . . 0.0 109.434 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 26.0 mmt -110.88 -22.94 11.28 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.203 0.525 . . . . 0.0 110.832 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 47.0 m -102.67 15.5 29.11 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.031 -179.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -159.38 129.97 5.85 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -154.11 -165.21 2.04 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.016 177.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -63.47 92.05 0.09 OUTLIER Glycine 0 C--N 1.308 -0.986 0 O-C-N 123.149 0.28 . . . . 0.0 113.775 -174.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 55.0 t30 65.03 40.59 5.05 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-O 121.844 0.83 . . . . 0.0 108.927 174.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -60.98 -24.23 65.96 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 176.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 3.4 m -55.08 -32.89 62.32 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 126.035 1.734 . . . . 0.0 111.486 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 59.8 tp -60.57 -54.98 38.84 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.035 0.445 . . . . 0.0 110.745 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -75.64 -27.45 58.4 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.591 -0.443 . . . . 0.0 111.113 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -63.41 -48.79 76.38 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 121.537 0.684 . . . . 0.0 109.728 175.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.526 HD21 ' HB3' ' A' ' 79' ' ' LEU . 31.8 tp -69.13 -27.97 66.04 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.285 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.19 -40.03 82.32 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 174.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 43.6 m -63.81 -39.53 94.46 Favored 'General case' 0 CA--C 1.552 1.021 0 CA-C-O 121.353 0.597 . . . . 0.0 109.402 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.1 t -68.44 -42.49 78.76 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.398 177.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -56.0 -45.85 78.9 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.898 1.679 . . . . 0.0 111.278 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 28.5 m -62.01 -28.3 69.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.195 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 7.1 tt -68.55 -37.46 79.97 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 23.8 m -76.23 -10.13 59.17 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.006 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 80.54 -39.57 0.16 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.022 1.729 . . . . 0.0 114.143 176.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 32.6 t -161.15 -77.58 0.05 Allowed 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.143 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -169.88 -177.87 2.76 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -172.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . 0.542 ' HA3' ' HA ' ' A' ' 30' ' ' PRO . . . -171.01 -114.15 0.31 Allowed Glycine 0 N--CA 1.434 -1.487 0 C-N-CA 120.245 -0.979 . . . . 0.0 112.527 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 163.79 163.1 15.88 Favored Glycine 0 N--CA 1.431 -1.638 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -178.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 157.16 35.57 0.02 OUTLIER Glycine 0 C--N 1.306 -1.129 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 34.0 m -68.95 153.94 42.92 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 122.784 0.434 . . . . 0.0 111.122 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 168.07 -169.32 41.34 Favored Glycine 0 N--CA 1.436 -1.329 0 C-N-CA 120.831 -0.7 . . . . 0.0 111.509 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -135.59 -104.92 0.78 Allowed Glycine 0 N--CA 1.433 -1.506 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 117.24 49.52 0.4 Allowed Glycine 0 C--N 1.305 -1.156 0 C-N-CA 121.189 -0.529 . . . . 0.0 112.686 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . 0.404 ' HB3' ' O ' ' B' ' 139' ' ' CYS . 65.2 m -67.32 134.5 51.66 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 178.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . 0.446 ' O ' ' HA ' ' B' ' 139' ' ' CYS . . . -121.74 -133.75 4.39 Favored Glycine 0 N--CA 1.44 -1.059 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 -178.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -133.25 65.09 0.59 Allowed Glycine 0 C--N 1.305 -1.177 0 C-N-CA 120.157 -1.02 . . . . 0.0 112.312 -178.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -137.37 -156.88 7.41 Favored Glycine 0 C--N 1.311 -0.837 0 C-N-CA 120.428 -0.891 . . . . 0.0 112.362 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 9.1 m -46.06 -84.03 0.01 OUTLIER 'General case' 0 CA--C 1.566 1.571 0 C-N-CA 125.464 1.506 . . . . 0.0 114.474 -175.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.437 HD11 ' HG2' ' A' ' 61' ' ' ARG . 87.7 mt -97.43 -24.84 15.43 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' B' ' 138' ' ' GLU . 9.4 pt-20 -62.11 -12.03 17.33 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 127.187 2.195 . . . . 0.0 114.182 -176.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' B' ' 133' ' ' GLY . 6.1 p -57.24 -59.54 4.96 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -139.67 96.86 3.15 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.514 ' HB3' ' HB ' ' B' ' 145' ' ' ILE . 69.3 mtp -97.76 -47.55 5.55 Favored 'General case' 0 C--N 1.292 -1.917 0 C-N-CA 119.486 -0.885 . . . . 0.0 110.423 -178.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 25.64 -84.13 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 127.853 2.461 . . . . 0.0 115.502 176.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.1 p -72.86 -47.1 48.96 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 114.55 -1.204 . . . . 0.0 111.216 -175.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 65.3 mt -63.79 -41.91 94.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.767 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.514 ' HB ' ' HB3' ' B' ' 141' ' ' MET . 9.5 tp -66.19 -41.32 89.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.097 0 C-N-CA 119.617 -0.833 . . . . 0.0 110.693 -178.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -66.17 -57.08 8.4 Favored 'General case' 0 N--CA 1.436 -1.128 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.133 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 43.4 t -55.2 -53.96 49.41 Favored 'General case' 0 C--O 1.249 1.049 0 C-N-CA 123.757 0.823 . . . . 0.0 113.133 -176.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.444 ' O ' ' HB1' ' A' ' 69' ' ' ALA . 5.5 mm-40 -81.84 -42.25 19.89 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -172.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.495 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 1.5 tm? -81.19 -53.32 6.47 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.469 -0.493 . . . . 0.0 110.358 -173.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.419 ' HG3' HD12 ' B' ' 149' ' ' LEU . 4.9 ppp? -177.16 117.46 0.1 Allowed 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 121.436 0.636 . . . . 0.0 110.614 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -80.82 -41.3 23.53 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 175.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.401 -2.912 0 N-CA-C 102.047 -3.316 . . . . 0.0 102.047 178.656 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.518 0 N-CA-C 111.772 -0.531 . . . . 0.0 111.772 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.2 t -86.13 116.77 29.6 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.403 ' H ' ' HD3' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -104.56 140.64 37.7 Favored 'General case' 0 N--CA 1.419 -1.997 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -177.485 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.503 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.6 ptpt -146.31 104.03 3.75 Favored 'General case' 0 C--N 1.266 -3.054 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.647 -178.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.414 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -74.02 -0.68 57.17 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 114.589 -1.187 . . . . 0.0 113.702 -175.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.503 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 52.2 p-90 -72.67 -7.74 51.86 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 117.57 0.685 . . . . 0.0 111.584 177.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.4 p80 -65.99 -9.61 31.84 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 9.7 pt-20 -88.13 -8.64 55.12 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.272 0.558 . . . . 0.0 110.027 174.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -94.98 9.89 37.67 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.533 0.682 . . . . 0.0 109.867 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.421 ' HB ' ' CB ' ' A' ' 61' ' ' ARG . 7.6 p -141.79 155.17 19.8 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.2 m -123.69 160.59 26.88 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.62 -36.1 71.34 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 120.903 0.382 . . . . 0.0 110.226 175.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 4.0 m-20 -63.68 -33.69 76.19 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.521 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.17 -51.13 19.01 Favored 'General case' 0 CA--C 1.498 -1.055 0 N-CA-C 107.016 -1.476 . . . . 0.0 107.016 -177.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.517 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.0 ptm180 -64.81 -44.18 90.75 Favored 'General case' 0 N--CA 1.423 -1.802 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.976 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.8 t -66.29 -29.17 69.34 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.438 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 18.2 t60 -65.18 -44.69 87.64 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.727 HD23 HD21 ' A' ' 68' ' ' LEU . 3.7 mp -66.6 -39.64 88.48 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.338 177.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 15' ' ' ARG . 55.0 t -57.45 -51.9 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.842 0.857 . . . . 0.0 110.3 175.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -55.98 -45.78 78.86 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.314 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.1 mttp -65.84 -40.22 91.55 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.245 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 19' ' ' VAL . 28.7 mt -51.26 -50.29 59.52 Favored 'General case' 0 CA--C 1.498 -1.048 0 O-C-N 123.676 0.61 . . . . 0.0 109.543 174.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.424 HG13 ' HB3' ' A' ' 43' ' ' LEU . 41.9 t -53.92 -51.69 42.92 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.497 0 O-C-N 124.468 1.105 . . . . 0.0 110.528 175.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -55.77 -35.41 66.21 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -176.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.486 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -81.44 -45.58 15.84 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 177.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.503 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.72 -25.49 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 122.044 0.926 . . . . 0.0 110.565 -174.682 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.587 ' CG ' HD22 ' A' ' 43' ' ' LEU . 57.6 m-85 -131.44 98.07 18.77 Favored Pre-proline 0 C--N 1.278 -2.514 0 CA-C-N 115.289 -0.869 . . . . 0.0 108.732 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -49.51 133.63 31.83 Favored 'Trans proline' 0 CA--C 1.48 -2.183 0 C-N-CA 122.394 2.063 . . . . 0.0 111.209 177.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.1 m -91.28 116.8 67.17 Favored Pre-proline 1 N--CA 1.369 -4.505 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.374 -174.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -79.92 -30.42 2.27 Favored 'Trans proline' 0 C--N 1.323 -0.78 0 C-N-CA 122.088 1.858 . . . . 0.0 111.255 176.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -147.84 147.43 27.03 Favored Pre-proline 0 CA--C 1.488 -1.431 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -69.2 -12.02 32.97 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 121.231 1.287 . . . . 0.0 110.283 172.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.32 -13.71 45.75 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.089 175.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.717 ' HA ' ' OD2' ' A' ' 37' ' ' ASP . . . -72.07 -15.17 62.01 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 122.18 0.991 . . . . 0.0 109.478 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.9 mt -85.36 7.34 22.79 Favored 'General case' 0 N--CA 1.426 -1.629 0 CA-C-N 113.592 -1.64 . . . . 0.0 109.403 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -132.89 0.44 3.5 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 118.984 -1.087 . . . . 0.0 109.914 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.717 ' OD2' ' HA ' ' A' ' 34' ' ' ALA . 48.5 m-20 -72.88 176.86 5.28 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.157 -175.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.645 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.7 OUTLIER -65.35 -21.81 66.74 Favored 'General case' 0 C--O 1.203 -1.342 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 170.637 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.636 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 41.0 ttp180 -65.04 -29.52 70.43 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.19 175.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.589 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.02 -39.57 82.31 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-O 118.763 -0.636 . . . . 0.0 110.209 -179.503 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.8 pt-20 -62.81 -28.37 69.96 Favored 'General case' 0 C--O 1.205 -1.257 0 O-C-N 123.238 0.336 . . . . 0.0 110.946 -176.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.637 HD22 HD23 ' A' ' 43' ' ' LEU . 4.6 t30 -76.17 -46.18 29.78 Favored 'General case' 0 C--O 1.265 1.911 0 CA-C-O 121.696 0.76 . . . . 0.0 110.008 177.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.637 HD23 HD22 ' A' ' 42' ' ' ASN . 18.3 mt -63.81 -49.57 72.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.204 -178.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 40' ' ' MET . 34.0 m -68.52 -33.17 58.57 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.294 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.383 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.21 -46.97 75.92 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 118.325 0.511 . . . . 0.0 109.991 175.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.543 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 6.6 t80 -63.1 -48.64 77.7 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.645 174.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.35 -43.52 88.35 Favored 'General case' 0 C--O 1.201 -1.474 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.356 -176.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -66.19 -40.77 90.65 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 124.117 0.967 . . . . 0.0 111.827 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 53.2 pttt -66.71 -40.71 88.55 Favored 'General case' 0 C--O 1.251 1.151 0 CA-C-O 121.497 0.665 . . . . 0.0 109.945 -178.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.412 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 79.3 t -71.63 -49.23 47.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.605 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE2' ' HB2' ' A' ' 15' ' ' ARG . 14.3 tm-20 -57.93 -47.67 82.18 Favored 'General case' 0 CA--C 1.51 -0.594 0 C-N-CA 123.836 0.854 . . . . 0.0 109.17 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.77 -38.72 92.61 Favored Glycine 0 N--CA 1.428 -1.859 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.445 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -64.11 -51.78 62.34 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 111.543 0.201 . . . . 0.0 111.543 178.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.437 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.4 OUTLIER -64.28 -32.38 73.96 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 178.025 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -64.78 -41.62 95.7 Favored 'General case' 0 C--O 1.201 -1.476 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -80.73 -16.78 53.0 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.622 -0.674 . . . . 0.0 112.097 177.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.3 t -82.78 -52.99 6.25 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 122.536 0.334 . . . . 0.0 111.433 -178.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.17 161.66 13.18 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -175.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -104.73 6.28 34.04 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.316 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.0 p -162.42 156.22 20.93 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 174.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' CB ' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -67.76 -31.15 70.84 Favored 'General case' 0 C--O 1.201 -1.499 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.458 -178.787 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -65.21 -47.22 77.64 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.303 177.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -58.26 -45.16 88.34 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 111.417 0.155 . . . . 0.0 111.417 175.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -44.14 92.21 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.513 -178.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -62.46 -45.59 92.35 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.295 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.529 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 34.0 m170 -61.1 -53.97 50.47 Favored 'General case' 0 C--O 1.215 -0.741 0 O-C-N 123.274 0.359 . . . . 0.0 111.634 -178.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.437 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.4 pp -64.33 -36.73 85.09 Favored 'General case' 0 C--O 1.256 1.417 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -175.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.727 HD21 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -74.67 -33.86 62.57 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.523 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.46 -32.76 74.3 Favored 'General case' 0 C--O 1.205 -1.275 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.343 175.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 22.1 mt-10 -72.4 -41.37 66.36 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.276 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -65.82 -39.03 90.45 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.403 179.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.523 HG22 ' HA ' ' A' ' 69' ' ' ALA . 8.7 tt -68.24 -42.99 85.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.297 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.491 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 39.1 t80 -58.19 -52.48 65.38 Favored 'General case' 0 C--O 1.259 1.578 0 C-N-CA 124.427 1.091 . . . . 0.0 111.348 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -64.4 -33.34 75.63 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.464 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -68.92 -37.68 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.867 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.167 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.509 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 11.5 mt-30 -66.6 -41.48 88.38 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.629 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.511 ' HE2' ' HB3' ' A' ' 77' ' ' LYS . 10.6 ptpt -75.23 -27.09 59.37 Favored 'General case' 0 N--CA 1.424 -1.763 0 C-N-CA 118.982 -1.087 . . . . 0.0 112.759 176.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.518 ' OE2' ' HG2' ' A' ' 82' ' ' LYS . 5.5 tm-20 -62.56 -48.89 77.51 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 175.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.597 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -63.7 -39.67 94.89 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.836 178.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -55.56 -53.6 54.4 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 123.466 0.479 . . . . 0.0 111.289 176.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -68.92 -47.03 66.78 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 120.15 -0.62 . . . . 0.0 112.418 -177.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.541 ' HA ' ' HG2' ' A' ' 86' ' ' ARG 0.254 0.0 OUTLIER -74.09 -38.73 63.79 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -176.337 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.523 ' HB2' ' O ' ' A' ' 79' ' ' LEU . 7.6 mmm180 -78.03 -26.08 48.23 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.408 ' HD2' ' HA ' ' A' ' 84' ' ' ARG . 12.9 tpt180 -98.74 -58.38 1.96 Allowed 'General case' 0 N--CA 1.427 -1.617 0 C-N-CA 117.689 -1.604 . . . . 0.0 112.153 -179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 70.5 m -161.75 96.26 1.02 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -173.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.541 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 4.9 ptt180 -158.58 -34.48 0.07 Allowed 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 120.971 0.415 . . . . 0.0 110.274 168.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 C--O 1.242 0.71 0 O-C-N 122.28 -0.262 . . . . 0.0 110.627 -176.778 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . 0.463 ' CA ' ' HB2' ' B' ' 113' ' ' ASP . . . . . . . . 0 CA--C 1.493 -1.296 0 N-CA-C 111.209 -0.757 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 8.9 m -81.02 24.74 0.49 Allowed 'General case' 0 C--N 1.308 -1.201 0 CA-C-O 121.372 0.606 . . . . 0.0 110.104 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . 0.491 ' HB2' HE22 ' B' ' 112' ' ' GLN . 82.9 mtp -78.48 -30.6 47.42 Favored 'General case' 0 CA--C 1.506 -0.712 0 C-N-CA 123.587 0.755 . . . . 0.0 110.634 -176.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 23.1 t -147.66 -59.26 0.26 Allowed 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -178.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -75.32 106.02 6.63 Favored 'General case' 0 C--O 1.215 -0.741 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 176.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -97.19 1.23 49.54 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.628 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -108.02 -64.42 0.58 Allowed Glycine 0 N--CA 1.432 -1.607 0 N-CA-C 109.384 -1.486 . . . . 0.0 109.384 174.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -93.74 52.64 1.71 Allowed 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.66 0.743 . . . . 0.0 109.343 178.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -59.65 -27.89 66.75 Favored 'General case' 0 C--O 1.249 1.031 0 CA-C-N 114.666 -1.152 . . . . 0.0 112.215 -178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 14.6 t -66.78 -25.25 66.38 Favored 'General case' 0 N--CA 1.421 -1.906 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.221 -179.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 43.3 tp -56.99 -59.78 4.55 Favored 'General case' 0 C--O 1.261 1.684 0 CA-C-N 118.192 0.451 . . . . 0.0 110.51 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.491 HE22 ' HB2' ' B' ' 103' ' ' MET . 20.4 pt20 -75.65 -35.51 60.41 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.895 -176.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . 0.463 ' HB2' ' CA ' ' B' ' 101' ' ' GLY . 22.7 t70 -67.98 -45.44 74.15 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.231 0.539 . . . . 0.0 110.845 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.597 HD21 ' HB3' ' A' ' 79' ' ' LEU . 52.9 tp -69.52 -32.04 70.64 Favored 'General case' 0 C--O 1.201 -1.454 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.038 179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 42.2 tp -67.83 -36.71 80.83 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.192 177.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 88.0 m -64.92 -46.73 80.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.097 176.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 17.5 m -64.12 -38.08 89.76 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.616 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -62.34 -46.86 86.78 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 123.746 0.818 . . . . 0.0 111.851 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 15.9 t -61.05 -22.7 64.83 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.273 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 8.3 tt -65.32 -44.25 88.42 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 45.4 m -77.16 -45.9 25.2 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.271 176.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 46.9 t60 71.89 -39.2 0.44 Allowed 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 126.268 1.827 . . . . 0.0 113.8 177.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 9.5 p -81.49 -171.94 3.56 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -88.21 176.66 7.15 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -177.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -89.46 118.38 5.2 Favored Glycine 0 N--CA 1.441 -0.992 0 N-CA-C 114.562 0.585 . . . . 0.0 114.562 -172.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -142.12 115.33 0.96 Allowed Glycine 0 C--N 1.294 -1.773 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 175.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -167.42 -163.85 22.04 Favored Glycine 0 N--CA 1.442 -0.963 0 C-N-CA 120.208 -0.996 . . . . 0.0 111.99 -178.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 16.8 m -78.9 -178.08 5.86 Favored 'General case' 0 C--N 1.316 -0.878 0 C-N-CA 123.975 0.91 . . . . 0.0 110.597 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -162.64 -49.96 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 119.729 -1.224 . . . . 0.0 113.935 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -85.74 -147.09 9.53 Favored Glycine 0 C--O 1.241 0.588 0 C-N-CA 121.425 -0.417 . . . . 0.0 113.299 -176.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 104.48 158.43 23.84 Favored Glycine 0 N--CA 1.441 -0.984 0 N-CA-C 110.79 -0.924 . . . . 0.0 110.79 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 32.2 p -148.33 -175.27 4.85 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 117.027 0.414 . . . . 0.0 109.949 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -138.14 -146.88 5.11 Favored Glycine 0 C--N 1.309 -0.951 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 177.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -162.19 -1.67 0.06 OUTLIER Glycine 0 C--N 1.31 -0.899 0 C-N-CA 119.557 -1.306 . . . . 0.0 113.848 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -80.86 -57.69 2.81 Favored Glycine 0 N--CA 1.436 -1.36 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.959 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 58.6 p -120.74 -97.05 0.46 Allowed 'General case' 0 CA--C 1.557 1.229 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 -173.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.4 HD11 ' HG2' ' A' ' 61' ' ' ARG . 24.7 mt -86.5 -29.34 22.81 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 122.905 1.336 . . . . 0.0 108.621 -175.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.555 ' HA ' ' SD ' ' B' ' 141' ' ' MET . 7.8 pt-20 -57.66 -13.52 4.11 Favored 'General case' 0 C--N 1.29 -2.003 0 C-N-CA 128.975 2.91 . . . . 0.0 116.221 -173.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 54.2 m -51.59 -57.03 10.27 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 118.474 0.579 . . . . 0.0 112.47 -174.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -149.12 77.17 1.35 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 123.176 1.465 . . . . 0.0 108.899 175.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.555 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 24.9 ptt? -104.35 -16.99 14.97 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 113.857 -1.519 . . . . 0.0 113.089 -176.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -28.51 -61.14 0.12 Allowed 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 126.543 1.937 . . . . 0.0 116.162 -172.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 18.5 m -68.04 -35.72 78.72 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.105 0.478 . . . . 0.0 111.48 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 62.1 mt -72.16 -45.79 60.9 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.891 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.601 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 18.0 tt -68.26 -31.57 52.09 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.4 -178.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 49.3 ttp180 -64.86 -54.75 26.07 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 33.1 t -59.24 -50.15 75.11 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.787 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -81.27 -42.69 20.28 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -175.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.601 ' HB3' ' O ' ' B' ' 145' ' ' ILE . 4.0 tt -80.6 -25.55 38.4 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -172.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . 0.28 0.0 OUTLIER -150.16 177.58 9.78 Favored 'General case' 0 N--CA 1.437 -1.122 0 C-N-CA 118.131 -1.428 . . . . 0.0 113.485 177.329 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -103.57 114.69 29.15 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -173.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.522 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 -179.882 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.492 -1.38 0 N-CA-C 112.165 -0.374 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.1 t -74.71 117.45 18.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.488 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.512 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -89.91 101.01 13.72 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.106 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 14.6 ptpt -109.78 93.74 4.66 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.669 -175.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.2 -12.26 16.02 Favored Glycine 0 N--CA 1.465 0.612 0 N-CA-C 116.075 1.19 . . . . 0.0 116.075 -173.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.471 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 57.3 p-90 -64.06 -17.07 63.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.542 0.671 . . . . 0.0 111.035 178.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.471 ' HA ' HG12 ' A' ' 10' ' ' VAL . 1.4 p-80 -63.33 -10.39 16.2 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.7 -30.45 59.32 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.349 0.595 . . . . 0.0 109.88 175.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -93.11 20.41 6.87 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.524 -174.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.471 HG12 ' HA ' ' A' ' 7' ' ' HIS . 7.7 p -132.98 110.19 15.1 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.492 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -75.89 153.07 36.98 Favored 'General case' 0 C--N 1.294 -1.839 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.916 -173.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -38.84 86.1 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 174.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.513 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 3.5 m-20 -56.91 -39.14 73.89 Favored 'General case' 0 C--O 1.214 -0.763 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.629 174.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.584 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -72.42 -52.35 16.33 Favored 'General case' 0 CA--C 1.494 -1.204 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 -173.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.514 ' O ' HG23 ' A' ' 19' ' ' VAL . 5.6 ptm180 -66.15 -43.37 87.21 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-N 114.944 -1.025 . . . . 0.0 113.293 -176.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 33.2 t -67.11 -28.66 68.34 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 14.9 t60 -65.71 -44.12 87.04 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 176.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.698 HD23 HD21 ' A' ' 68' ' ' LEU . 4.1 mp -65.26 -41.41 94.27 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.888 176.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 15' ' ' ARG . 67.6 t -57.21 -52.42 56.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.665 0.786 . . . . 0.0 110.169 176.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.435 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 20.5 t-80 -54.93 -43.79 73.65 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.494 177.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.476 ' HD3' ' HG ' ' B' ' 149' ' ' LEU . 36.2 mttp -66.1 -37.95 87.02 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.375 177.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 19' ' ' VAL . 74.2 mt -55.67 -43.08 75.99 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 175.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.482 ' HA ' HG22 ' A' ' 26' ' ' ILE . 53.6 t -57.25 -52.65 53.84 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.628 0 O-C-N 124.155 0.91 . . . . 0.0 110.411 173.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -59.05 -29.15 67.09 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.71 -45.31 15.88 Favored 'General case' 0 C--O 1.207 -1.133 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.769 174.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.482 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.7 tt -69.78 -33.75 57.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-O 122.07 0.938 . . . . 0.0 110.233 -177.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -126.39 92.26 45.77 Favored Pre-proline 0 N--CA 1.4 -2.971 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -57.7 102.17 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.055 0 C-N-CA 121.849 1.7 . . . . 0.0 107.955 171.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 t -73.92 128.27 86.88 Favored Pre-proline 0 N--CA 1.408 -2.568 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.637 -172.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -72.65 -28.83 13.66 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.417 2.078 . . . . 0.0 111.438 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -151.01 147.12 20.04 Favored Pre-proline 0 CA--C 1.498 -1.033 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -177.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.41 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 9.9 Cg_endo -56.93 -19.66 33.03 Favored 'Trans proline' 0 CA--C 1.549 1.274 0 C-N-CA 122.359 2.039 . . . . 0.0 114.171 175.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.38 -19.97 59.24 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 121.406 -0.809 . . . . 0.0 112.005 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.68 -7.56 50.99 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.383 0.611 . . . . 0.0 110.421 178.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.462 ' O ' ' HG2' ' A' ' 40' ' ' MET . 23.6 mt -93.48 0.31 56.68 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.689 -178.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -133.72 19.77 3.87 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.243 0.544 . . . . 0.0 111.979 -177.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.548 ' O ' ' HB3' ' A' ' 40' ' ' MET . 38.0 t70 -92.12 176.69 6.4 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.734 ' HD2' ' N ' ' A' ' 39' ' ' ARG . 5.4 ppt_? -61.54 -26.1 67.72 Favored 'General case' 0 C--N 1.282 -2.358 0 CA-C-O 121.922 0.868 . . . . 0.0 108.934 172.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.734 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 40.6 ttm180 -63.52 -29.41 70.68 Favored 'General case' 0 N--CA 1.426 -1.625 0 CA-C-O 122.145 0.974 . . . . 0.0 109.109 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.726 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.7 tpp -65.13 -34.64 78.89 Favored 'General case' 0 C--O 1.192 -1.95 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.312 -178.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.631 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.1 pt-20 -63.64 -32.89 74.51 Favored 'General case' 0 C--O 1.189 -2.081 0 C-N-CA 119.396 -0.922 . . . . 0.0 109.445 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -68.99 -49.85 54.21 Favored 'General case' 0 C--O 1.244 0.782 0 CA-C-O 121.589 0.709 . . . . 0.0 110.045 176.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 67.2 mt -63.7 -48.07 78.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.6 -176.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.726 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.4 p -73.42 -27.88 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.885 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.209 -178.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.56 93.94 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 177.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.539 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.1 t80 -60.73 -46.36 90.74 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.942 174.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.23 -40.17 93.01 Favored 'General case' 0 C--O 1.202 -1.443 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.956 -177.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -68.38 -43.72 76.73 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 123.312 0.645 . . . . 0.0 111.306 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.3 pttp -65.74 -38.18 88.42 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 121.118 0.485 . . . . 0.0 109.918 -177.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 41.3 t -70.76 -49.66 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.268 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.401 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.8 tm-20 -56.04 -44.67 79.0 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.49 -37.97 95.6 Favored Glycine 0 N--CA 1.439 -1.147 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.62 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -59.42 -54.25 48.81 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.445 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -67.67 -34.22 76.5 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.93 -49.85 75.79 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -77.33 -17.68 58.08 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 28.3 t -87.42 -30.85 20.4 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 120.825 0.345 . . . . 0.0 110.929 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.29 159.51 23.13 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 121.246 0.546 . . . . 0.0 111.633 -177.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -108.59 8.48 27.15 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-O 121.717 0.77 . . . . 0.0 110.4 -177.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 83.1 p -160.71 160.71 31.78 Favored 'General case' 0 N--CA 1.417 -2.101 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 173.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.426 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -72.3 -26.76 62.08 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.047 176.677 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -65.48 -47.82 74.77 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -62.83 -46.22 88.94 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.163 177.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.404 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.64 -48.09 76.09 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.845 -176.419 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -61.38 -45.36 94.67 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 123.796 0.685 . . . . 0.0 110.304 178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.543 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 10.7 t60 -67.95 -49.86 59.3 Favored 'General case' 0 C--O 1.203 -1.372 0 CA-C-O 119.23 -0.414 . . . . 0.0 111.752 -176.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.445 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.1 pp -64.55 -35.37 80.76 Favored 'General case' 0 C--O 1.271 2.219 0 CA-C-N 118.517 0.599 . . . . 0.0 111.662 -177.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.698 HD21 HD23 ' A' ' 18' ' ' LEU . 1.3 pp -70.1 -38.55 75.67 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.548 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.75 -35.74 82.06 Favored 'General case' 0 C--O 1.2 -1.508 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.561 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 16.0 mt-10 -67.76 -43.78 79.04 Favored 'General case' 0 C--N 1.312 -1.039 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.684 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -38.93 74.76 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 118.663 -1.215 . . . . 0.0 111.732 -179.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.548 HG22 ' HA ' ' A' ' 69' ' ' ALA . 9.6 tt -65.62 -40.41 87.92 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 C-N-CA 120.564 -0.455 . . . . 0.0 110.112 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.493 ' CZ ' ' HE3' ' A' ' 77' ' ' LYS . 36.6 t80 -57.31 -54.5 46.15 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 124.682 1.193 . . . . 0.0 111.121 179.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.473 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 16.5 ptpt -66.44 -32.34 73.64 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.083 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -66.78 -36.92 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.809 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.154 177.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.566 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 19.6 mt-30 -67.44 -47.75 69.26 Favored 'General case' 0 CA--C 1.498 -1.056 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.635 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.505 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -69.45 -28.12 65.83 Favored 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 119.404 -0.919 . . . . 0.0 112.627 177.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 3.6 tp10 -65.16 -47.85 75.59 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -65.41 -36.07 82.82 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.533 -178.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.98 -47.29 78.08 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.351 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.37 -33.37 65.01 Favored 'General case' 0 C--O 1.213 -0.852 0 C-N-CA 119.49 -0.884 . . . . 0.0 111.773 -179.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.553 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -64.58 -36.17 83.37 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.794 178.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.417 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 16.2 tpp180 -77.66 -36.47 51.38 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.227 178.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 8.5 tpp180 -87.54 -59.68 2.18 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 119.648 -0.821 . . . . 0.0 112.955 -175.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.9 p -178.95 81.99 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -110.22 -25.61 10.06 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 171.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.7 mt . . . . . 0 C--O 1.245 0.834 0 CA-C-N 114.227 -1.352 . . . . 0.0 109.061 175.947 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.232 0 N-CA-C 111.435 -0.666 . . . . 0.0 111.435 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 16.7 m -77.71 109.7 11.92 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 49.4 tpp -132.53 -31.78 1.36 Allowed 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.588 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 14.1 t 49.79 44.86 25.05 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 124.152 0.981 . . . . 0.0 111.389 176.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 60.0 t60 -127.43 -26.82 2.98 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -174.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 67.23 -164.75 0.22 Allowed 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -172.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.41 -58.64 4.86 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 -176.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -118.24 34.58 5.11 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 123.753 0.821 . . . . 0.0 110.235 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.33 -27.2 68.88 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.389 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 6.9 m -64.02 -39.47 94.17 Favored 'General case' 0 N--CA 1.421 -1.917 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.683 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 60.9 tp -68.41 -33.43 74.21 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.32 -0.4 . . . . 0.0 109.956 178.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -64.71 -53.02 53.91 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.444 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -60.8 -39.3 88.39 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.181 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.558 HD21 ' HB3' ' A' ' 79' ' ' LEU . 62.4 tp -62.71 -44.62 95.77 Favored 'General case' 0 C--O 1.203 -1.389 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.618 177.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 60.8 tp -63.57 -38.82 92.57 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 26.4 m -65.19 -40.15 93.84 Favored 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.983 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.3 t -77.53 -25.58 50.34 Favored 'General case' 0 CA--C 1.561 1.389 0 CA-C-O 121.28 0.562 . . . . 0.0 110.204 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -69.09 -37.75 78.59 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 121.951 0.882 . . . . 0.0 109.163 176.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 19.1 p -76.25 -11.32 59.89 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.257 175.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 3.9 tt -85.08 -29.9 24.51 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 43.0 m -67.5 -38.32 84.14 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.58 175.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 62.5 m80 72.98 -45.37 0.62 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 125.163 1.385 . . . . 0.0 112.641 178.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 24.6 m -122.77 139.2 54.25 Favored 'General case' 0 N--CA 1.421 -1.91 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -76.51 151.57 36.36 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -145.9 -84.32 0.06 OUTLIER Glycine 0 C--N 1.298 -1.536 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 170.42 162.58 23.0 Favored Glycine 0 N--CA 1.427 -1.947 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.408 176.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -113.38 38.11 3.34 Favored Glycine 0 N--CA 1.432 -1.61 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 177.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 2.3 p -80.28 132.68 35.87 Favored 'General case' 0 N--CA 1.425 -1.694 0 C-N-CA 123.671 0.789 . . . . 0.0 111.394 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 176.33 154.23 11.46 Favored Glycine 0 N--CA 1.424 -2.138 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 167.72 -158.07 30.72 Favored Glycine 0 C--N 1.298 -1.554 0 N-CA-C 109.225 -1.55 . . . . 0.0 109.225 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 126.65 32.23 0.72 Allowed Glycine 0 C--N 1.308 -0.977 0 C-N-CA 119.272 -1.442 . . . . 0.0 113.859 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 48.4 t 62.05 -157.74 0.33 Allowed 'General case' 0 CA--C 1.561 1.374 0 CA-C-N 116.947 0.374 . . . . 0.0 110.713 176.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -175.66 -62.75 0.06 OUTLIER Glycine 0 N--CA 1.433 -1.506 0 N-CA-C 111.609 -0.596 . . . . 0.0 111.609 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . 0.403 ' N ' ' HG2' ' B' ' 138' ' ' GLU . . . 94.14 121.68 3.42 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.926 -0.654 . . . . 0.0 111.785 -178.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 151.78 -49.72 0.53 Allowed Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.529 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 23.2 t -159.87 -78.55 0.06 Allowed 'General case' 0 CA--C 1.556 1.204 0 CA-C-N 116.885 0.343 . . . . 0.0 111.711 -178.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 70.5 mt -97.17 -30.38 13.04 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-O 121.811 0.815 . . . . 0.0 111.132 -173.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.571 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 0.0 OUTLIER -77.75 -13.19 59.97 Favored 'General case' 0 C--N 1.291 -1.96 0 C-N-CA 124.866 1.267 . . . . 0.0 112.97 -172.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 34.6 t -49.28 -59.41 3.71 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.56 0.744 . . . . 0.0 111.233 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -140.4 73.05 1.41 Allowed 'General case' 0 CA--C 1.494 -1.179 0 CA-C-O 122.093 0.949 . . . . 0.0 109.025 174.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.517 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 26.8 ptt? -102.92 -18.67 14.95 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.633 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -22.02 -65.42 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 126.876 2.071 . . . . 0.0 116.218 -174.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.4 p -69.84 -43.92 70.97 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.256 0.551 . . . . 0.0 112.01 -176.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 45.8 mm -69.57 -40.54 79.7 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.465 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 13.2 tt -67.42 -36.78 77.47 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.863 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -55.03 -51.64 65.65 Favored 'General case' 0 C--O 1.25 1.11 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 15.3 m -61.48 -52.36 64.83 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-N 114.509 -1.223 . . . . 0.0 112.567 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -68.52 -47.83 65.94 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.48 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 2.5 tm? -76.03 -40.79 52.68 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 114.953 -1.021 . . . . 0.0 112.756 -168.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . 0.299 3.7 ppp? -150.23 -48.55 0.13 Allowed 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 117.86 2.541 . . . . 0.0 117.86 -175.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 27.5 t70 46.1 88.54 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 124.453 1.101 . . . . 0.0 113.034 -178.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.303 0 CA-C-O 118.528 -0.749 . . . . 0.0 109.168 179.996 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.481 -2.04 0 N-CA-C 110.734 -0.947 . . . . 0.0 110.734 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 82.1 t -111.07 119.43 59.61 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.104 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.5 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -68.46 109.43 3.69 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.844 0.83 . . . . 0.0 109.585 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.624 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.3 ptpt -130.63 105.38 7.78 Favored 'General case' 0 C--N 1.28 -2.419 0 CA-C-N 114.603 -1.18 . . . . 0.0 112.048 -176.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.15 -9.65 84.1 Favored Glycine 0 C--O 1.24 0.517 0 CA-C-N 115.076 -0.965 . . . . 0.0 113.273 -175.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.624 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 65.0 p-90 -68.73 -7.59 35.07 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -59.83 -26.17 65.57 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 120.977 0.418 . . . . 0.0 111.703 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -86.81 0.33 55.04 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.547 0.689 . . . . 0.0 110.677 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.404 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 52.0 m-70 -104.95 3.01 30.28 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.953 -178.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.773 HG22 ' HB3' ' A' ' 61' ' ' ARG . 1.5 t -119.28 128.51 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.681 0 N-CA-C 103.968 -2.604 . . . . 0.0 103.968 176.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.478 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 2.8 m -77.66 151.46 34.26 Favored 'General case' 0 C--N 1.275 -2.665 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -36.15 79.35 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 174.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 32.8 t70 -72.66 -27.83 62.35 Favored 'General case' 0 C--O 1.199 -1.581 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.619 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.449 ' H ' ' HB ' ' A' ' 11' ' ' THR . 3.2 tm? -70.03 -52.95 19.92 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -177.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 1.1 ptm180 -57.89 -48.67 79.16 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 175.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.4 m -67.89 -21.19 65.16 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.192 0.52 . . . . 0.0 111.816 -177.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.446 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 15.9 t60 -69.63 -47.24 64.11 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 175.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.648 HD23 HD21 ' A' ' 68' ' ' LEU . 1.2 mp -64.83 -40.52 95.31 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.768 177.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' ARG . 78.8 t -56.69 -50.38 74.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.68 0.792 . . . . 0.0 109.939 174.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 27.0 t-80 -54.86 -44.15 73.74 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.861 0.864 . . . . 0.0 109.907 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.4 ' HZ3' ' CD1' ' B' ' 145' ' ' ILE . 76.7 mttt -69.48 -36.63 76.72 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.924 178.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' HG22 ' A' ' 26' ' ' ILE . 63.7 mt -56.38 -45.28 80.64 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 175.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.428 ' HA ' HG22 ' A' ' 26' ' ' ILE . 42.1 t -54.88 -55.56 15.26 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.41 0 O-C-N 124.211 0.944 . . . . 0.0 109.907 172.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -56.63 -30.1 62.93 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -176.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.606 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.32 -45.14 16.62 Favored 'General case' 0 C--O 1.208 -1.081 0 O-C-N 122.18 -0.325 . . . . 0.0 111.717 175.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.428 HG22 ' HA ' ' A' ' 23' ' ' VAL . 2.8 tt -70.82 -34.92 58.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 122.051 0.929 . . . . 0.0 110.304 -179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.467 ' CD2' HD22 ' A' ' 43' ' ' LEU . 11.0 m-85 -136.99 88.01 18.35 Favored Pre-proline 0 C--N 1.267 -3.003 0 C-N-CA 124.357 1.063 . . . . 0.0 109.751 -177.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -44.76 133.03 10.47 Favored 'Trans proline' 0 CA--C 1.487 -1.864 0 C-N-CA 122.696 2.264 . . . . 0.0 112.431 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 m -90.27 117.92 68.41 Favored Pre-proline 1 N--CA 1.364 -4.737 0 CA-C-N 114.291 -1.322 . . . . 0.0 111.746 -173.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.471 ' HA ' ' O ' ' B' ' 124' ' ' ASP . 55.2 Cg_endo -76.29 -32.38 4.04 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.702 2.268 . . . . 0.0 111.745 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -153.59 144.17 15.83 Favored Pre-proline 0 CA--C 1.489 -1.372 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 -177.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.449 ' HA ' HD12 ' A' ' 35' ' ' LEU . 9.4 Cg_endo -56.02 -23.25 42.71 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.68 2.253 . . . . 0.0 113.817 176.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.26 -14.18 60.88 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 121.377 -0.827 . . . . 0.0 111.719 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 40' ' ' MET . . . -72.29 -15.55 61.9 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.697 0.761 . . . . 0.0 109.487 176.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.85 ' HA ' ' HE3' ' A' ' 40' ' ' MET . 10.4 mt -88.32 -0.87 57.63 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.043 -176.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.39 16.82 4.04 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.648 0.737 . . . . 0.0 109.29 176.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.584 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 17.0 t70 -86.36 173.55 9.62 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.109 -176.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.584 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.67 -25.68 62.21 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.025 0.44 . . . . 0.0 110.651 174.262 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.588 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 6.4 tpt180 -62.84 -38.09 89.4 Favored 'General case' 0 C--O 1.245 0.827 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 175.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.85 ' HE3' ' HA ' ' A' ' 35' ' ' LEU . 9.3 tpp -56.16 -37.18 69.19 Favored 'General case' 0 C--O 1.192 -1.932 0 CA-C-N 113.574 -1.648 . . . . 0.0 112.691 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -61.79 -32.73 73.04 Favored 'General case' 0 C--O 1.212 -0.887 0 C-N-CA 118.972 -1.091 . . . . 0.0 110.652 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.476 HD22 HD23 ' A' ' 43' ' ' LEU . 5.4 t30 -77.21 -43.5 33.43 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-O 121.406 0.622 . . . . 0.0 110.0 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 20.5 mt -63.72 -45.71 88.7 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.644 -178.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.839 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.0 p -73.34 -28.58 25.84 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.368 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.13 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.24 -44.23 95.43 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 176.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.531 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.5 t80 -62.51 -45.8 91.33 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.888 173.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.72 91.55 Favored 'General case' 0 C--O 1.202 -1.431 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.943 -177.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -68.25 -41.05 81.71 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 123.608 0.763 . . . . 0.0 112.375 178.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.531 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 58.3 pttt -65.84 -40.3 91.6 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 55.5 t -71.06 -48.33 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.884 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -58.25 -45.72 87.28 Favored 'General case' 0 CA--C 1.506 -0.737 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.85 -42.42 96.6 Favored Glycine 0 N--CA 1.433 -1.522 0 O-C-N 123.928 0.768 . . . . 0.0 112.744 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -58.18 -54.7 44.03 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.489 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.6 OUTLIER -67.0 -33.9 76.56 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 179.502 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -63.62 -45.17 91.52 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -79.05 -16.59 56.59 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 121.888 -0.507 . . . . 0.0 111.727 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.489 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 29.9 m -87.1 -27.81 22.89 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.63 167.39 15.38 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.52 0.676 . . . . 0.0 112.576 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -115.31 8.63 15.47 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.532 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.4 p -166.66 150.27 7.05 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 175.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.773 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -60.82 -34.15 74.1 Favored 'General case' 0 C--O 1.199 -1.598 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.3 175.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.78 -47.91 83.79 Favored 'General case' 0 C--O 1.219 -0.542 0 O-C-N 123.857 0.723 . . . . 0.0 109.571 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -62.96 -47.34 83.61 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.715 177.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.407 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.57 -46.39 82.94 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.875 -176.768 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -60.92 -44.87 96.59 Favored 'General case' 0 C--O 1.208 -1.13 0 O-C-N 123.84 0.713 . . . . 0.0 109.752 177.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.426 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 53.6 t-80 -58.43 -57.21 13.95 Favored 'General case' 0 C--N 1.323 -0.543 0 O-C-N 123.606 0.566 . . . . 0.0 111.815 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.473 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.7 pp -65.41 -37.11 85.97 Favored 'General case' 0 C--O 1.27 2.156 0 CA-C-O 121.317 0.579 . . . . 0.0 112.167 -175.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.648 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -70.7 -36.89 73.48 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 -179.174 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.52 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -62.72 -38.39 90.28 Favored 'General case' 0 C--O 1.209 -1.077 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.232 178.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 53.5 mm-40 -61.15 -51.23 69.93 Favored 'General case' 0 C--O 1.262 1.735 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.701 179.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -39.38 81.11 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.587 -0.845 . . . . 0.0 112.621 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.582 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 6.8 tt -64.49 -44.89 96.96 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.891 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.803 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.411 ' CE1' ' HE2' ' A' ' 77' ' ' LYS . 65.3 t80 -53.4 -52.79 58.19 Favored 'General case' 0 C--O 1.259 1.574 0 C-N-CA 125.227 1.411 . . . . 0.0 111.238 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.67 -32.26 73.72 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.808 -178.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.606 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.5 mp -70.83 -35.63 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.298 176.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 72' ' ' ILE . 22.7 mm-40 -60.03 -47.58 85.25 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 122.08 0.943 . . . . 0.0 109.703 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.1 OUTLIER -72.79 -28.12 62.4 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.521 -0.872 . . . . 0.0 112.872 178.605 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.455 ' OE2' HD22 ' B' ' 111' ' ' LEU . 0.6 OUTLIER -60.39 -53.43 57.73 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 175.609 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.6 pp -60.35 -41.59 93.97 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.941 -177.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.479 ' HB3' ' NH2' ' A' ' 84' ' ' ARG . 12.5 mm-40 -59.1 -53.67 55.7 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.239 176.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.9 pt-20 -71.58 -37.76 70.99 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -174.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.73 -33.36 62.34 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -75.65 -31.64 59.89 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.852 0.834 . . . . 0.0 109.915 178.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.479 ' NH2' ' HB3' ' A' ' 80' ' ' GLU . 34.2 ttm180 -75.1 -21.39 58.93 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.702 -1.136 . . . . 0.0 109.237 175.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 54.8 m 86.19 128.88 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 126.482 1.913 . . . . 0.0 113.16 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.428 ' HG3' HD12 ' A' ' 87' ' ' LEU . 12.1 ptt180 -133.05 -29.98 1.39 Allowed 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.782 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.428 HD12 ' HG3' ' A' ' 86' ' ' ARG . 8.7 mp . . . . . 0 N--CA 1.473 0.698 0 O-C-N 122.166 -0.334 . . . . 0.0 110.159 175.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.508 -0.383 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 7.6 p -69.83 -21.6 63.36 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 123.398 0.679 . . . . 0.0 112.355 -176.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 96.8 mmm -93.27 3.06 56.28 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.577 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 45.6 t 66.48 -176.11 0.19 Allowed 'General case' 0 CA--C 1.549 0.928 0 O-C-N 123.716 0.635 . . . . 0.0 110.511 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -105.96 -5.41 19.62 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -89.38 176.55 6.88 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.784 177.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 84.51 -39.19 2.91 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.444 ' H ' HD22 ' B' ' 108' ' ' ASN . 0.1 OUTLIER -136.6 23.4 3.15 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -177.655 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 5.2 pm0 -56.74 -40.69 76.2 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.516 -179.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 22.7 m -73.4 -32.57 64.51 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.391 -176.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.455 HD22 ' OE2' ' A' ' 78' ' ' GLU . 7.8 mt -66.3 -47.93 72.0 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -175.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -71.69 -41.64 68.38 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.647 -177.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -59.74 -53.26 60.08 Favored 'General case' 0 C--O 1.251 1.149 0 CA-C-O 121.883 0.849 . . . . 0.0 109.453 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.419 HD21 ' HB3' ' A' ' 79' ' ' LEU . 50.8 tp -67.51 -27.12 66.72 Favored 'General case' 0 C--O 1.189 -2.115 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.783 -179.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.412 ' HA ' ' HB3' ' B' ' 118' ' ' ASP . 59.0 tp -68.6 -40.01 80.64 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 121.334 0.588 . . . . 0.0 109.685 176.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 36.6 m -60.72 -38.1 83.97 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.14 178.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 19.4 m -72.27 -50.46 26.98 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-O 121.388 0.613 . . . . 0.0 111.062 174.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' B' ' 115' ' ' LEU . 3.2 t70 -56.05 -18.61 10.03 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 126.766 2.026 . . . . 0.0 113.941 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 78.6 p -56.78 -19.34 16.52 Favored 'General case' 0 CA--C 1.562 1.415 0 CA-C-O 120.905 0.383 . . . . 0.0 111.654 174.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 39.3 tp -66.95 -47.02 72.91 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.86 0.864 . . . . 0.0 111.434 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 7.3 p -77.12 -40.72 44.7 Favored 'General case' 0 C--O 1.245 0.853 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -174.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 55.2 m-70 72.59 -72.98 0.1 Allowed 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.473 1.109 . . . . 0.0 110.955 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 20.9 t 171.57 85.48 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 104.051 -2.574 . . . . 0.0 104.051 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . 0.471 ' O ' ' HA ' ' A' ' 30' ' ' PRO . 24.4 t70 -175.92 128.71 0.23 Allowed 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -171.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -151.72 101.92 0.22 Allowed Glycine 0 N--CA 1.44 -1.053 0 C-N-CA 120.981 -0.628 . . . . 0.0 111.847 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -92.34 9.31 76.38 Favored Glycine 0 C--N 1.308 -1.025 0 N-CA-C 114.49 0.556 . . . . 0.0 114.49 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 148.41 167.36 13.56 Favored Glycine 0 C--N 1.312 -0.751 0 C-N-CA 119.971 -1.109 . . . . 0.0 112.656 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 28.2 t -164.61 -159.06 0.44 Allowed 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 94.71 -68.45 1.26 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.626 -0.321 . . . . 0.0 112.669 178.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 87.34 -106.24 3.15 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 120.724 -0.75 . . . . 0.0 111.748 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -160.51 179.11 36.22 Favored Glycine 0 N--CA 1.435 -1.376 0 N-CA-C 111.064 -0.814 . . . . 0.0 111.064 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 20.1 m -154.14 123.3 6.44 Favored 'General case' 0 C--N 1.308 -1.203 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -83.39 -133.16 2.13 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.645 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -174.13 79.25 0.08 OUTLIER Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.39 -0.91 . . . . 0.0 111.735 179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -127.91 -40.69 0.3 Allowed Glycine 0 C--N 1.295 -1.7 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 16.6 p -140.75 -79.48 0.27 Allowed 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -177.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 39.4 mt -105.06 -17.3 14.54 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -172.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.465 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 0.0 OUTLIER -82.23 -13.03 57.69 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 -167.418 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 48.5 t -72.15 -60.0 2.45 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 118.742 0.701 . . . . 0.0 110.964 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -109.8 66.16 0.63 Allowed 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 179.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.439 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 25.4 ttt -102.66 -22.74 13.92 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 113.994 -1.457 . . . . 0.0 113.539 -170.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -42.37 -53.36 4.25 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 -169.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 14.3 p -64.82 -50.43 66.73 Favored 'General case' 0 C--O 1.255 1.375 0 CA-C-O 121.55 0.691 . . . . 0.0 111.115 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 63.2 mt -58.0 -50.77 76.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.78 -177.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.483 HD11 HD22 ' B' ' 149' ' ' LEU . 0.0 OUTLIER -67.01 -40.37 85.41 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.276 -177.252 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.446 ' HA ' ' O ' ' B' ' 150' ' ' MET . 16.5 ttp180 -64.61 -58.5 6.18 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 118.954 -1.098 . . . . 0.0 111.23 -176.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.9 m -66.1 -41.1 91.07 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 113.302 0.852 . . . . 0.0 113.302 -175.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -81.6 -48.05 12.26 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.349 0.499 . . . . 0.0 112.349 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.508 HD21 HD13 ' A' ' 72' ' ' ILE . 9.4 tt -95.86 -42.83 8.13 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -170.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.446 ' O ' ' HA ' ' B' ' 146' ' ' ARG . 0.0 OUTLIER -178.16 130.21 0.14 Allowed 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.625 1.102 . . . . 0.0 113.229 -178.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -119.57 -58.95 1.87 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 105.156 -2.165 . . . . 0.0 105.156 172.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.446 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 172.699 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.482 -1.988 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.451 ' O ' ' HG3' ' A' ' 4' ' ' LYS . 58.3 t 66.15 104.24 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.044 0.937 . . . . 0.0 109.627 -175.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.6 106.65 6.28 Favored 'General case' 0 C--N 1.278 -2.523 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.032 -178.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 2' ' ' VAL . 43.6 mttp -104.98 123.08 47.17 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.184 -0.916 . . . . 0.0 108.891 -177.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.43 -15.47 61.47 Favored Glycine 0 C--N 1.315 -0.639 0 O-C-N 123.428 0.455 . . . . 0.0 113.88 -174.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -72.38 -8.35 54.5 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 122.335 -0.509 . . . . 0.0 112.355 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.418 ' HD2' ' O ' ' A' ' 4' ' ' LYS . 12.5 p80 -62.4 -21.89 65.73 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 121.315 0.579 . . . . 0.0 110.425 178.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -78.17 -7.44 57.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.985 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -112.91 18.01 18.48 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.936 -178.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.57 125.48 19.05 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -86.23 159.24 19.52 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -176.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.435 HE21 ' HB3' ' A' ' 12' ' ' GLN . 0.6 OUTLIER -59.01 -38.21 78.71 Favored 'General case' 0 C--O 1.208 -1.096 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 170.28 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.518 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 6.6 m-20 -65.86 -31.24 72.07 Favored 'General case' 0 C--O 1.202 -1.421 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.57 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -67.55 -51.88 45.44 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 179.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.58 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.0 ptm180 -64.61 -46.78 81.15 Favored 'General case' 0 N--CA 1.41 -2.444 0 CA-C-N 114.209 -1.359 . . . . 0.0 112.536 -177.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 45.6 t -66.45 -23.19 66.24 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-O 121.275 0.56 . . . . 0.0 110.899 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.518 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 9.5 t60 -69.54 -47.35 64.01 Favored 'General case' 0 C--O 1.247 0.946 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 176.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.806 HD23 HD21 ' A' ' 68' ' ' LEU . 5.2 mp -65.01 -41.57 95.23 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.323 -1.308 . . . . 0.0 109.898 177.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 15' ' ' ARG . 67.7 t -55.81 -48.67 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 124.115 0.966 . . . . 0.0 110.39 175.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -55.75 -48.82 74.61 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.433 178.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.439 ' HE2' ' O ' ' B' ' 130' ' ' GLY . 37.5 mttm -65.1 -37.31 87.07 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.026 178.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.464 ' O ' HG22 ' A' ' 26' ' ' ILE . 57.2 mt -53.51 -49.33 67.79 Favored 'General case' 0 CA--C 1.502 -0.869 0 O-C-N 123.577 0.548 . . . . 0.0 109.8 175.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.499 HG11 ' HE1' ' A' ' 40' ' ' MET . 58.6 t -54.87 -51.88 48.43 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.147 0 O-C-N 124.328 1.017 . . . . 0.0 110.172 175.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -56.72 -31.94 65.02 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -177.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.672 ' HB2' ' NE2' ' A' ' 76' ' ' GLN . . . -81.14 -45.94 15.65 Favored 'General case' 0 C--O 1.215 -0.757 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 176.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.464 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -79.9 -27.38 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-O 122.055 0.931 . . . . 0.0 111.013 -173.719 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -133.17 87.37 39.27 Favored Pre-proline 0 C--N 1.285 -2.21 0 C-N-CA 124.516 1.126 . . . . 0.0 108.997 177.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -58.37 116.1 3.01 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.164 1.909 . . . . 0.0 110.48 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.2 t -88.93 132.41 38.27 Favored Pre-proline 0 N--CA 1.424 -1.741 0 CA-C-O 121.104 0.478 . . . . 0.0 111.308 -174.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.63 -28.7 13.86 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.595 2.197 . . . . 0.0 111.331 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -148.98 155.61 40.48 Favored Pre-proline 0 C--N 1.31 -1.117 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.483 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.512 ' HA ' HD12 ' A' ' 35' ' ' LEU . 57.1 Cg_endo -73.52 -7.44 20.29 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.005 1.803 . . . . 0.0 114.367 179.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.59 -20.62 26.15 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 121.519 -0.738 . . . . 0.0 110.049 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.77 -12.31 58.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.863 0.839 . . . . 0.0 110.031 174.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 32' ' ' PRO . 27.6 mt -89.53 2.14 54.99 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.713 -1.13 . . . . 0.0 111.029 -179.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.89 9.93 4.22 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.742 0.782 . . . . 0.0 109.432 175.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.637 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 15.7 t70 -86.78 174.28 8.9 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 124.888 1.275 . . . . 0.0 111.004 -175.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.637 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -64.69 -29.19 70.18 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 123.266 0.626 . . . . 0.0 111.17 179.454 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.537 ' O ' HD13 ' A' ' 43' ' ' LEU . 41.2 ttm180 -66.38 -37.24 84.81 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 177.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.809 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 7.5 tpp -58.06 -35.56 71.53 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.716 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.2 pt-20 -61.64 -30.98 71.07 Favored 'General case' 0 C--O 1.209 -1.077 0 C-N-CA 118.63 -1.228 . . . . 0.0 109.369 -178.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -74.8 -46.44 36.82 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.461 177.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.624 HD22 ' HA ' ' A' ' 40' ' ' MET . 1.2 mp -55.1 -58.39 7.87 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.342 179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.809 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.8 p -69.59 -29.27 40.82 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.346 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.744 -176.155 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.3 -47.45 85.35 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.554 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 2.3 t80 -59.93 -44.83 94.11 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 174.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.42 -42.29 99.34 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.055 -177.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -65.3 -44.11 88.97 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 123.2 0.6 . . . . 0.0 111.002 178.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.554 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 53.7 pttt -65.25 -40.71 94.37 Favored 'General case' 0 C--O 1.246 0.877 0 CA-C-O 121.284 0.564 . . . . 0.0 110.623 -178.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.446 HG21 ' CE2' ' A' ' 46' ' ' TYR . 43.0 t -70.95 -44.21 75.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.953 178.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.4 tm-20 -56.89 -46.66 81.73 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.09 -34.29 88.54 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.202 177.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.413 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 30.0 t70 -61.21 -53.8 52.34 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.005 0.431 . . . . 0.0 110.326 178.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.457 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -70.35 -31.07 68.19 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -59.47 -48.82 80.18 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -76.78 -24.9 52.88 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.516 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.8 t -80.33 -11.23 59.73 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -107.53 165.63 11.27 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.975 0.416 . . . . 0.0 111.503 -178.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -112.39 14.21 20.34 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.376 0.607 . . . . 0.0 111.529 177.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 99.6 p -162.26 153.53 17.99 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 171.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.514 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -58.59 -41.18 85.19 Favored 'General case' 0 C--O 1.192 -1.932 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.978 174.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -65.35 -39.92 92.98 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.435 -178.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -63.53 -50.43 69.6 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.145 175.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.467 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -62.7 -44.24 96.75 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.827 -177.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.48 -46.82 88.71 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 124.166 0.916 . . . . 0.0 110.44 177.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.595 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 24.2 t60 -63.38 -50.96 67.83 Favored 'General case' 0 C--O 1.202 -1.419 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.457 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -64.68 -37.66 88.33 Favored 'General case' 0 C--O 1.276 2.493 0 CA-C-O 121.514 0.674 . . . . 0.0 111.877 -176.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.806 HD21 HD23 ' A' ' 18' ' ' LEU . 1.5 pp -69.59 -35.5 75.38 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 178.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.542 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.83 -35.5 80.83 Favored 'General case' 0 C--O 1.204 -1.298 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.747 177.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 26.6 mt-10 -66.23 -47.37 74.02 Favored 'General case' 0 C--O 1.252 1.233 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.861 -179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.84 -40.47 87.96 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 118.578 -1.249 . . . . 0.0 110.599 -178.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.542 HG22 ' HA ' ' A' ' 69' ' ' ALA . 4.4 tt -65.74 -44.13 93.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.117 -178.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.441 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 53.9 t80 -56.39 -53.11 61.25 Favored 'General case' 0 C--O 1.273 2.304 0 C-N-CA 125.36 1.464 . . . . 0.0 110.947 -178.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.5 ptpt -63.48 -39.55 94.74 Favored 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.661 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.535 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -61.89 -39.21 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 123.343 0.402 . . . . 0.0 111.514 178.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.7 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 28.7 mm-40 -60.1 -53.48 57.28 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.452 ' HE2' ' HB3' ' A' ' 77' ' ' LYS . 6.7 ptpt -73.6 -28.78 62.0 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.469 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 8.1 tp10 -59.29 -47.94 83.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 175.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.1 pp -67.27 -37.42 83.42 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.188 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.492 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 4.7 mm-40 -61.12 -53.19 60.1 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 12.0 pt-20 -73.36 -32.96 64.82 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.556 ' HE2' ' HG3' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -66.07 -31.03 71.67 Favored 'General case' 0 C--N 1.352 0.674 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.095 179.081 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.556 ' HG3' ' HE2' ' A' ' 82' ' ' LYS . 51.3 mtm180 -78.11 -39.47 41.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.866 173.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 54.3 ttt180 -71.6 -60.63 2.13 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 114.841 1.423 . . . . 0.0 114.841 -169.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 33.1 t -177.55 27.56 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 119.104 -1.039 . . . . 0.0 113.79 -171.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.456 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 1.1 ptp180 -84.6 -14.12 49.66 Favored 'General case' 0 C--N 1.31 -1.149 0 C-N-CA 117.452 -1.699 . . . . 0.0 110.033 176.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--N 1.305 -1.355 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 173.567 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.929 0 N-CA-C 111.144 -0.782 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 18.6 m 61.98 29.42 17.74 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.816 0.847 . . . . 0.0 109.507 -178.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 60.0 mtt -69.84 -30.26 67.71 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.052 -172.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 40.9 m 61.56 32.23 18.7 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.797 0.808 . . . . 0.0 111.36 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 29.5 m170 -105.27 -52.99 2.73 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 121.751 0.786 . . . . 0.0 109.242 178.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -69.66 136.42 51.1 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.732 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 118.61 -49.04 0.89 Allowed Glycine 0 N--CA 1.423 -2.177 0 N-CA-C 108.484 -1.846 . . . . 0.0 108.484 -175.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -157.98 73.75 0.69 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 122.204 1.002 . . . . 0.0 108.832 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.87 -22.31 34.06 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.119 -1.4 . . . . 0.0 108.933 176.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 10.4 t -63.66 -27.31 69.14 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.76 -176.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 6.5 tt -63.79 -43.42 96.38 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -71.78 -41.62 68.12 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.917 -176.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.63 -47.22 87.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.437 -0.802 . . . . 0.0 108.967 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.546 HD21 ' HB3' ' A' ' 79' ' ' LEU . 50.7 tp -65.37 -34.14 77.6 Favored 'General case' 0 C--O 1.19 -2.042 0 CA-C-N 114.651 -1.159 . . . . 0.0 111.43 179.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 55.6 tp -65.61 -33.73 76.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.104 0.478 . . . . 0.0 109.829 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 31.3 m -64.45 -45.38 87.67 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.417 175.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.406 ' O ' ' HB3' ' B' ' 120' ' ' LEU . 13.0 m -67.77 -35.21 78.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 121.746 0.784 . . . . 0.0 110.095 176.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 6.4 t70 -63.82 -31.95 73.29 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 125.494 1.518 . . . . 0.0 109.903 -178.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 27.0 m -64.51 -24.98 67.79 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.711 178.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.406 ' HB3' ' O ' ' B' ' 117' ' ' SER . 7.7 tt -74.47 -32.4 62.56 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 121.425 0.631 . . . . 0.0 109.464 178.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 33.7 t -76.82 -15.34 59.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.369 177.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 67.26 23.31 9.4 Favored 'General case' 0 C--O 1.242 0.685 0 C-N-CA 124.073 0.949 . . . . 0.0 108.468 -173.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 50.9 m 60.04 44.19 13.53 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 114.05 -1.432 . . . . 0.0 111.51 -178.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -81.65 -53.94 5.81 Favored 'General case' 0 C--O 1.247 0.944 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.565 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 152.91 -171.72 31.95 Favored Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 109.054 -1.618 . . . . 0.0 109.054 -178.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -120.07 16.16 10.11 Favored Glycine 0 C--N 1.315 -0.634 0 C-N-CA 120.185 -1.007 . . . . 0.0 112.764 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 72.82 -157.74 52.7 Favored Glycine 0 N--CA 1.443 -0.899 0 N-CA-C 111.777 -0.529 . . . . 0.0 111.777 -178.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 19.6 m -97.07 129.63 44.47 Favored 'General case' 0 N--CA 1.426 -1.653 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -72.77 94.7 0.68 Allowed Glycine 0 C--N 1.313 -0.74 0 C-N-CA 120.416 -0.897 . . . . 0.0 111.952 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . 0.439 ' O ' ' HE2' ' A' ' 21' ' ' LYS . . . -114.04 -159.38 13.01 Favored Glycine 0 C--N 1.314 -0.645 0 C-N-CA 121.502 -0.38 . . . . 0.0 112.891 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 145.0 166.33 11.61 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 10.4 t -143.72 -176.74 5.09 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 118.27 1.035 . . . . 0.0 109.535 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 135.4 170.03 12.01 Favored Glycine 0 N--CA 1.442 -0.94 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -178.44 89.67 0.08 OUTLIER Glycine 0 N--CA 1.447 -0.612 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -146.92 -29.73 0.07 OUTLIER Glycine 0 N--CA 1.438 -1.217 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.517 -178.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 16.3 p -145.41 -70.5 0.27 Allowed 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 117.378 0.589 . . . . 0.0 112.297 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.644 ' O ' ' HB2' ' B' ' 141' ' ' MET . 71.9 mt -105.26 -32.85 8.43 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 120.846 0.355 . . . . 0.0 111.272 -177.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.421 ' CD ' ' H ' ' B' ' 138' ' ' GLU . 0.0 OUTLIER -75.53 -13.22 60.35 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 115.854 1.798 . . . . 0.0 115.854 -165.042 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 44.8 t -73.59 -39.29 64.72 Favored 'General case' 0 C--N 1.314 -0.976 0 C-N-CA 119.159 -1.016 . . . . 0.0 110.245 -178.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -115.67 22.41 13.15 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.621 -176.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.644 ' HB2' ' O ' ' B' ' 137' ' ' LEU . 44.4 ttp -90.57 -12.84 35.87 Favored 'General case' 0 C--O 1.205 -1.244 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -171.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -38.24 -60.13 0.81 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 116.519 2.044 . . . . 0.0 116.519 -174.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 15.9 m -66.78 -39.67 87.89 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.22 0.533 . . . . 0.0 110.212 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 86.2 mt -64.98 -53.01 46.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.847 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.507 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 18.4 tt -68.37 -31.6 52.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 120.928 0.394 . . . . 0.0 112.061 -175.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 32.2 ttp180 -69.45 -51.52 35.38 Favored 'General case' 0 N--CA 1.419 -1.993 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.688 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 53.6 p -67.4 -42.45 83.28 Favored 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -80.62 -40.28 25.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -176.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.496 HD23 ' HG3' ' B' ' 150' ' ' MET . 10.0 tt -98.55 -36.37 9.93 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -171.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.496 ' HG3' HD23 ' B' ' 149' ' ' LEU 0.281 4.6 ppp? -169.78 97.31 0.3 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.153 0.978 . . . . 0.0 112.602 179.176 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -97.85 12.6 33.46 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.609 -177.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.367 0 CA-C-N 114.587 -1.188 . . . . 0.0 109.583 -179.185 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.486 -1.772 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.3 t -81.45 116.67 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 179.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.553 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -63.6 101.49 0.35 Allowed 'General case' 0 C--N 1.299 -1.623 0 O-C-N 124.037 0.835 . . . . 0.0 111.046 178.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.426 ' HB2' ' NE1' ' A' ' 6' ' ' TRP . 13.8 ptpt -130.86 90.45 2.9 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.521 177.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.9 -20.25 1.77 Allowed Glycine 0 N--CA 1.473 1.136 0 C-N-CA 125.7 1.619 . . . . 0.0 116.842 -171.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.426 ' NE1' ' HB2' ' A' ' 4' ' ' LYS . 65.6 p-90 -66.12 -15.07 62.79 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 117.444 0.622 . . . . 0.0 111.562 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.571 ' HB2' ' OH ' ' A' ' 55' ' ' TYR . 8.9 p80 -59.8 -25.08 64.65 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.171 0.588 . . . . 0.0 111.634 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -84.81 -9.33 58.27 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 120.921 0.391 . . . . 0.0 110.85 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.422 ' CD2' ' HA ' ' A' ' 6' ' ' TRP . 30.2 m-70 -88.83 -8.01 55.12 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 121.389 0.614 . . . . 0.0 109.557 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.779 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -106.17 140.97 22.54 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.333 0 N-CA-C 105.664 -1.976 . . . . 0.0 105.664 177.456 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.711 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -107.18 158.47 17.07 Favored 'General case' 0 C--N 1.276 -2.624 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -51.4 -41.49 60.76 Favored 'General case' 0 N--CA 1.438 -1.034 0 O-C-N 125.352 1.657 . . . . 0.0 109.993 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.422 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 18.7 m-20 -69.34 -39.35 78.21 Favored 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.04 179.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.572 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -63.62 -50.53 68.99 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 -179.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.711 ' HG2' ' O ' ' A' ' 11' ' ' THR 0.261 17.3 mmm-85 -51.54 -57.92 7.74 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 123.642 0.589 . . . . 0.0 109.704 175.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.0 t -66.02 -26.84 67.71 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.829 -171.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.422 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 11.0 t60 -70.54 -46.93 62.66 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.724 HD23 HD21 ' A' ' 68' ' ' LEU . 4.3 mp -68.12 -38.84 82.67 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.761 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 15' ' ' ARG . 73.7 t -56.76 -48.44 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 C-N-CA 123.618 0.767 . . . . 0.0 110.114 174.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -56.84 -49.01 76.71 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.682 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.579 ' HZ3' HG13 ' B' ' 145' ' ' ILE . 84.2 mttt -63.43 -39.83 95.52 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.769 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.482 ' O ' HG22 ' A' ' 26' ' ' ILE . 5.7 mt -51.01 -52.84 38.9 Favored 'General case' 0 CA--C 1.506 -0.75 0 O-C-N 123.99 0.806 . . . . 0.0 110.577 174.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.65 HG11 ' HE1' ' A' ' 40' ' ' MET . 59.3 t -55.54 -51.24 60.0 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.17 0 O-C-N 124.031 0.832 . . . . 0.0 110.38 176.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -54.62 -35.94 63.96 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -175.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.519 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.2 -45.54 16.18 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 178.01 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.545 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.97 -23.84 15.05 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 CA-C-O 122.251 1.024 . . . . 0.0 110.925 -174.834 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.545 ' CD2' HG23 ' A' ' 26' ' ' ILE . 63.0 m-85 -134.32 94.57 17.52 Favored Pre-proline 0 C--N 1.282 -2.358 0 C-N-CA 124.85 1.26 . . . . 0.0 107.735 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -65.96 89.54 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 121.906 1.737 . . . . 0.0 110.655 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.441 HG21 HD21 ' A' ' 35' ' ' LEU . 14.5 t -59.3 128.96 86.29 Favored Pre-proline 0 N--CA 1.429 -1.49 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.307 -174.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -73.78 -17.75 22.62 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 123.082 2.521 . . . . 0.0 112.059 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -160.13 146.36 11.86 Favored Pre-proline 0 CA--C 1.492 -1.282 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -61.35 -19.01 62.35 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 121.997 1.798 . . . . 0.0 113.913 176.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -80.05 -11.84 59.74 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.5 -0.88 . . . . 0.0 111.818 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.05 -6.61 53.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.862 0.839 . . . . 0.0 109.523 175.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.484 ' O ' ' HG2' ' A' ' 40' ' ' MET . 24.6 mt -91.36 0.9 57.45 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.059 -178.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -133.3 18.8 4.01 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 122.195 0.998 . . . . 0.0 108.63 178.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.587 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 27.9 t70 -96.29 177.18 5.79 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 113.811 -1.541 . . . . 0.0 112.041 -173.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.587 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.96 -25.11 62.58 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 124.203 1.001 . . . . 0.0 111.058 179.173 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.589 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 43.0 ttm180 -76.11 -27.84 57.25 Favored 'General case' 0 N--CA 1.44 -0.973 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 176.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.839 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 10.7 tpp -59.02 -36.64 75.3 Favored 'General case' 0 C--O 1.197 -1.675 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.167 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 9.4 pt-20 -59.24 -32.97 70.46 Favored 'General case' 0 C--O 1.189 -2.103 0 C-N-CA 119.558 -0.857 . . . . 0.0 109.952 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.417 HD22 HD23 ' A' ' 43' ' ' LEU . 4.7 t30 -76.57 -43.33 39.32 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 123.23 0.612 . . . . 0.0 110.465 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.0 mt -63.26 -48.62 77.44 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.199 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.839 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.3 p -73.28 -28.33 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.719 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.137 -178.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -59.81 -45.67 91.64 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.58 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 13.0 t80 -61.79 -47.86 83.23 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.917 174.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.06 -43.05 91.67 Favored 'General case' 0 C--O 1.203 -1.372 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.234 -178.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -66.06 -39.96 90.51 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 123.7 0.8 . . . . 0.0 112.181 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.58 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 15.4 pttp -69.84 -37.36 76.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.359 0.599 . . . . 0.0 109.712 -178.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.414 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 65.3 t -70.98 -50.0 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.101 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.404 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.5 tm-20 -57.11 -46.79 82.33 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.964 0.906 . . . . 0.0 109.575 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.67 -40.47 98.04 Favored Glycine 0 CA--C 1.507 -0.413 0 O-C-N 123.587 0.555 . . . . 0.0 112.235 178.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -59.66 -54.34 47.58 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 122.785 0.434 . . . . 0.0 110.799 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.518 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.99 -34.17 77.81 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 178.118 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.571 ' OH ' ' HB2' ' A' ' 7' ' ' HIS . 68.1 t80 -59.48 -52.74 64.28 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 174.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.84 -18.55 61.44 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-O 121.705 0.764 . . . . 0.0 111.837 -179.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.464 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 17.4 m -85.46 -27.16 25.89 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -87.55 167.23 14.12 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -176.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.426 HD22 ' C ' ' A' ' 59' ' ' ASN . 0.2 OUTLIER -108.6 5.83 25.37 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.641 177.559 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.519 ' HB2' ' OD1' ' A' ' 62' ' ' ASP . 42.0 p -169.87 154.33 5.22 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 178.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.779 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -62.46 -36.24 81.82 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-O 121.247 0.546 . . . . 0.0 110.51 179.859 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.519 ' OD1' ' HB2' ' A' ' 60' ' ' SER . 1.2 p-10 -62.79 -38.62 91.4 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 124.548 1.139 . . . . 0.0 111.202 177.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -70.57 -44.35 67.58 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.705 0.288 . . . . 0.0 110.874 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.454 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -66.28 -43.83 85.26 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.331 -177.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.64 -40.11 93.72 Favored 'General case' 0 C--O 1.199 -1.566 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.514 176.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -60.2 -57.73 11.57 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.238 0.336 . . . . 0.0 111.633 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.518 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.7 pp -69.1 -30.43 68.72 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.717 -174.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.724 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -76.08 -32.57 59.31 Favored 'General case' 0 N--CA 1.435 -1.221 0 C-N-CA 119.85 -0.74 . . . . 0.0 109.073 178.366 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.527 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -66.47 -36.8 83.66 Favored 'General case' 0 C--O 1.206 -1.234 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.37 -44.14 92.34 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.757 177.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.517 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -68.96 -39.05 79.71 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 119.966 -0.694 . . . . 0.0 111.137 179.011 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.527 HG22 ' HA ' ' A' ' 69' ' ' ALA . 10.5 tt -68.91 -40.61 81.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.302 -179.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.558 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 26.1 t80 -57.49 -51.22 70.33 Favored 'General case' 0 C--O 1.261 1.669 0 C-N-CA 124.711 1.204 . . . . 0.0 111.303 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.53 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.8 ptpt -63.53 -40.6 97.44 Favored 'General case' 0 C--O 1.199 -1.565 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.519 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.5 mp -60.7 -38.77 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 O-C-N 123.717 0.636 . . . . 0.0 111.01 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.526 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 28.1 mt-30 -69.26 -45.0 70.8 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 120.265 -0.574 . . . . 0.0 111.855 -177.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.583 ' HA ' ' HG2' ' A' ' 80' ' ' GLU . 10.9 ptpt -74.35 -27.6 60.75 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 118.858 -1.137 . . . . 0.0 112.362 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 7.1 tp10 -61.02 -49.2 78.38 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 174.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.591 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.5 pp -65.9 -42.13 90.63 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -177.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.583 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 9.6 pt-20 -69.48 -39.18 77.81 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 119.444 -0.903 . . . . 0.0 112.652 -177.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -69.44 -39.59 77.73 Favored 'General case' 0 C--O 1.213 -0.817 0 C-N-CA 118.877 -1.129 . . . . 0.0 110.534 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.552 ' HD3' HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -69.25 -31.66 70.35 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 120.564 -0.454 . . . . 0.0 111.016 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.42 ' HG2' ' HE2' ' A' ' 82' ' ' LYS . 5.5 mmt180 -77.1 -46.61 22.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.913 178.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 22.8 tpt180 -90.61 -58.48 2.47 Favored 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 -173.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 26.8 p -165.49 97.29 0.68 Allowed 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -173.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.533 ' HD2' ' HA ' ' A' ' 82' ' ' LYS . 5.0 ptm180 -126.97 -30.65 2.7 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 119.816 -0.753 . . . . 0.0 109.362 172.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 C--O 1.251 1.133 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.026 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.953 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 49.1 m 62.15 25.22 15.08 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.532 1.133 . . . . 0.0 112.677 178.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 27.8 ttt -76.37 -30.69 57.66 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 36.1 m -111.01 136.31 50.22 Favored 'General case' 0 N--CA 1.422 -1.856 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 174.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . 0.43 ' O ' ' HB3' ' B' ' 109' ' ' GLN . 69.0 m80 -86.73 119.17 26.68 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -93.29 -11.92 31.33 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.649 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -71.81 99.25 0.83 Allowed Glycine 0 CA--C 1.496 -1.096 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 176.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 58.59 47.0 13.89 Favored 'General case' 0 C--O 1.249 1.055 0 CA-C-O 121.606 0.717 . . . . 0.0 110.236 -174.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.43 ' HB3' ' O ' ' B' ' 105' ' ' HIS . 3.2 pp0? -59.15 -29.77 67.68 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.54 177.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 3.5 m -55.35 -53.19 59.29 Favored 'General case' 0 N--CA 1.419 -1.992 0 C-N-CA 125.075 1.35 . . . . 0.0 110.8 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.34 -47.0 68.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.604 -176.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.464 ' O ' HG22 ' B' ' 116' ' ' THR . 11.7 pt20 -68.18 -42.29 80.19 Favored 'General case' 0 C--O 1.246 0.914 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -176.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.39 -41.03 94.14 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.591 HD21 ' HB3' ' A' ' 79' ' ' LEU . 56.0 tp -73.35 -29.08 62.42 Favored 'General case' 0 C--O 1.208 -1.123 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.745 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.552 HD13 ' HD3' ' A' ' 82' ' ' LYS . 61.8 tp -71.22 -38.4 72.0 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.372 -0.83 . . . . 0.0 110.463 178.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.464 HG22 ' O ' ' B' ' 112' ' ' GLN . 3.1 t -71.32 -35.84 71.37 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 119.834 -0.746 . . . . 0.0 111.644 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 20.1 p -69.84 -33.33 72.15 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.595 0.712 . . . . 0.0 109.874 175.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 11.9 t70 -62.91 -36.19 82.57 Favored 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 124.621 1.168 . . . . 0.0 109.976 176.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 30.0 m -65.77 -20.43 66.26 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.643 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 7.6 tt -71.16 -33.53 70.11 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 123.076 0.55 . . . . 0.0 110.406 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 9.4 m -76.47 -30.09 57.17 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.196 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 70.17 -62.18 0.44 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.2 1.4 . . . . 0.0 112.523 -179.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 12.5 p -74.02 177.61 5.55 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 123.986 0.915 . . . . 0.0 113.385 -173.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -108.47 104.58 13.95 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.442 -178.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 160.93 174.73 31.14 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.501 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -146.29 105.14 0.32 Allowed Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 179.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -90.62 98.92 2.51 Favored Glycine 0 N--CA 1.442 -0.952 0 C-N-CA 121.199 -0.524 . . . . 0.0 113.359 -175.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 22.8 t -88.81 156.58 18.87 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -170.9 44.92 0.19 Allowed Glycine 0 N--CA 1.438 -1.17 0 N-CA-C 110.286 -1.125 . . . . 0.0 110.286 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -94.85 -113.71 2.63 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.554 -0.832 . . . . 0.0 112.099 -176.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 160.2 -169.31 36.04 Favored Glycine 0 N--CA 1.433 -1.506 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 -179.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 24.2 p -151.71 150.66 30.47 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 116.829 0.315 . . . . 0.0 110.28 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 147.66 150.08 5.11 Favored Glycine 0 N--CA 1.438 -1.198 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 165.96 -63.62 0.22 Allowed Glycine 0 C--N 1.296 -1.681 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 123.04 16.53 3.56 Favored Glycine 0 N--CA 1.434 -1.457 0 C-N-CA 121.367 -0.444 . . . . 0.0 112.745 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 24.5 m -118.66 -90.65 0.57 Allowed 'General case' 0 N--CA 1.423 -1.819 0 O-C-N 122.507 -0.408 . . . . 0.0 111.4 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.449 ' HB2' ' CD2' ' A' ' 14' ' ' LEU . 82.0 mt -107.07 -41.71 5.09 Favored 'General case' 0 C--O 1.204 -1.339 0 CA-C-O 121.412 0.625 . . . . 0.0 110.118 -177.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.23 -26.78 41.78 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 126.696 1.998 . . . . 0.0 113.984 -175.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 5.0 p -86.9 -12.11 48.69 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-O 121.135 0.493 . . . . 0.0 111.916 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -130.58 31.5 4.54 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 -176.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.592 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 21.1 ttt -100.81 -26.48 13.75 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 113.684 -1.598 . . . . 0.0 113.157 -166.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -34.26 -59.99 0.42 Allowed 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 -172.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 6.4 m -69.22 -38.3 78.48 Favored 'General case' 0 C--O 1.253 1.247 0 CA-C-O 121.587 0.708 . . . . 0.0 110.43 -176.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 58.6 mt -69.94 -46.77 72.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.415 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.592 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 0.0 OUTLIER -63.56 -36.65 77.16 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.76 -179.051 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -61.4 -65.41 0.7 Allowed 'General case' 0 N--CA 1.428 -1.575 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.395 178.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 27.2 p -64.2 -54.02 40.08 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -173.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -80.78 -35.14 33.56 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -173.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.466 HD21 HD13 ' A' ' 72' ' ' ILE . 10.1 tt -94.6 -33.05 13.16 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -171.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 25.8 ptt? -157.5 26.91 0.29 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 116.081 -2.248 . . . . 0.0 115.033 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 15.4 t70 79.17 -77.18 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 125.617 1.567 . . . . 0.0 113.39 170.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.843 0 CA-C-O 118.966 -0.54 . . . . 0.0 111.377 -176.861 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.371 0 CA-C-O 119.958 -0.357 . . . . 0.0 112.895 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.3 m -136.05 154.69 34.09 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.541 0 CA-C-N 118.128 0.964 . . . . 0.0 111.385 -178.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.424 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -122.56 111.33 16.66 Favored 'General case' 0 N--CA 1.423 -1.8 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 175.123 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.429 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 10.8 ptpt -152.69 104.72 2.9 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.772 -177.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.18 -22.28 13.6 Favored Glycine 0 CA--C 1.521 0.44 0 CA-C-N 114.338 -1.301 . . . . 0.0 115.83 -175.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.429 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 56.9 p-90 -64.37 -9.41 17.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 117.734 0.767 . . . . 0.0 112.279 179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -62.58 -17.04 59.27 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 122.382 0.273 . . . . 0.0 111.621 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -86.44 -10.5 54.1 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.268 0.556 . . . . 0.0 110.359 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.414 ' HB3' ' NE ' ' A' ' 61' ' ' ARG . 24.7 m-70 -87.98 5.94 38.33 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.68 0.752 . . . . 0.0 109.575 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.606 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -133.51 114.01 19.86 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.703 0 N-CA-C 105.285 -2.117 . . . . 0.0 105.285 178.564 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.72 174.74 7.84 Favored 'General case' 0 C--N 1.276 -2.592 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -28.79 70.33 Favored 'General case' 0 C--O 1.202 -1.399 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -57.72 -48.25 80.11 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 178.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.607 ' HB2' ' HG2' ' B' ' 138' ' ' GLU . 3.4 tm? -66.4 -54.45 24.21 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -175.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.541 ' O ' HG23 ' A' ' 19' ' ' VAL . 2.8 ptm180 -60.9 -45.16 95.7 Favored 'General case' 0 N--CA 1.42 -1.956 0 CA-C-N 114.629 -1.169 . . . . 0.0 113.996 -178.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.1 t -65.3 -30.35 71.2 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 117.816 0.28 . . . . 0.0 110.756 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -66.31 -45.16 81.27 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.834 HD23 HD21 ' A' ' 68' ' ' LEU . 6.3 mp -66.33 -40.23 89.75 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.497 178.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.5 t -58.98 -49.75 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 124.022 0.929 . . . . 0.0 110.271 175.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -54.84 -44.13 73.66 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.969 0.908 . . . . 0.0 110.04 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -67.96 -41.64 82.14 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.103 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.452 ' O ' HG22 ' A' ' 26' ' ' ILE . 55.5 mt -51.91 -48.03 64.36 Favored 'General case' 0 CA--C 1.501 -0.909 0 O-C-N 123.515 0.509 . . . . 0.0 110.025 175.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.514 HG11 ' HE1' ' A' ' 40' ' ' MET . 41.8 t -55.81 -55.42 17.91 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.881 0 O-C-N 124.284 0.99 . . . . 0.0 110.471 175.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -57.21 -29.7 63.95 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -176.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.401 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -81.48 -45.91 15.3 Favored 'General case' 0 C--O 1.21 -1.007 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 176.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.452 HG22 ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -76.86 -26.31 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-O 121.961 0.886 . . . . 0.0 110.141 -174.461 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.509 ' CG ' HD22 ' A' ' 43' ' ' LEU . 14.4 m-85 -138.81 88.09 14.07 Favored Pre-proline 0 N--CA 1.418 -2.058 0 C-N-CA 125.394 1.477 . . . . 0.0 108.717 177.147 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -57.09 106.33 0.22 Allowed 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 121.74 1.626 . . . . 0.0 109.214 177.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.0 t -66.85 130.08 94.0 Favored Pre-proline 0 N--CA 1.422 -1.833 0 CA-C-O 121.161 0.505 . . . . 0.0 111.164 -174.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.91 -31.6 12.42 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.534 2.156 . . . . 0.0 111.696 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -144.81 148.1 37.94 Favored Pre-proline 0 CA--C 1.49 -1.344 0 N-CA-C 107.389 -1.337 . . . . 0.0 107.389 -176.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -69.12 -12.98 35.44 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.566 1.511 . . . . 0.0 112.286 178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -84.64 -14.53 48.35 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.408 177.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.83 -11.19 60.5 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.877 0.846 . . . . 0.0 109.037 176.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.448 ' HA ' ' CE ' ' A' ' 40' ' ' MET . 23.9 mt -86.92 5.47 36.9 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.414 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -136.12 6.64 3.11 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.82 -0.55 . . . . 0.0 111.556 173.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.642 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 30.9 t70 -81.31 177.56 8.92 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.698 -176.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.642 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -70.93 -19.3 62.59 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.566 0.698 . . . . 0.0 110.468 175.225 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.62 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 17.3 tpp180 -70.3 -31.94 69.5 Favored 'General case' 0 N--CA 1.435 -1.221 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.572 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -57.95 -41.01 81.95 Favored 'General case' 0 CA--C 1.478 -1.803 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.149 -179.424 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 7.7 pt-20 -60.15 -33.98 72.91 Favored 'General case' 0 C--O 1.208 -1.122 0 O-C-N 123.785 0.678 . . . . 0.0 110.763 -175.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.533 HD22 HD23 ' A' ' 43' ' ' LEU . 6.9 t30 -73.6 -44.66 56.58 Favored 'General case' 0 C--O 1.245 0.818 0 CA-C-O 121.38 0.609 . . . . 0.0 109.901 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 8.8 mt -65.53 -45.73 82.35 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.262 -176.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 40' ' ' MET . 29.1 m -69.33 -31.45 49.6 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.139 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.205 178.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.56 -45.2 89.48 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 177.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.52 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 5.4 t80 -63.17 -48.6 77.72 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.57 0.544 . . . . 0.0 110.373 173.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.83 -42.04 88.29 Favored 'General case' 0 C--O 1.201 -1.499 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.188 -176.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -68.36 -41.12 81.1 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 123.843 0.857 . . . . 0.0 111.669 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.52 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 57.3 pttt -67.06 -39.33 86.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.728 0.775 . . . . 0.0 109.546 -178.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.466 HG21 ' CE2' ' A' ' 46' ' ' TYR . 42.9 t -72.54 -45.9 57.22 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.164 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.14 179.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 14.7 tm-20 -58.02 -47.53 82.79 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 177.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.89 -39.35 95.38 Favored Glycine 0 N--CA 1.449 -0.48 0 O-C-N 123.646 0.591 . . . . 0.0 112.436 178.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -59.09 -54.26 49.03 Favored 'General case' 0 C--N 1.314 -0.943 0 C-N-CA 123.703 0.801 . . . . 0.0 110.741 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.484 ' HA ' ' HB2' ' A' ' 57' ' ' SER . 0.4 OUTLIER -69.98 -28.33 65.45 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 178.123 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -66.25 -47.55 73.4 Favored 'General case' 0 C--O 1.201 -1.464 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -73.48 -26.4 60.89 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.187 0.517 . . . . 0.0 111.334 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.484 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 25.6 m -75.89 -33.04 59.92 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.27 170.39 15.45 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.432 0.634 . . . . 0.0 112.237 -178.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -120.18 13.15 11.98 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.423 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 67.8 p -166.86 152.85 8.15 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 174.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.606 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -64.75 -27.4 68.87 Favored 'General case' 0 C--O 1.204 -1.328 0 C-N-CA 118.43 -1.308 . . . . 0.0 110.22 175.328 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -63.07 -47.71 81.75 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.78 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.1 -44.27 89.36 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.317 176.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.408 ' HD1' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -64.83 -45.35 86.51 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.583 -177.046 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.54 -41.99 98.16 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.215 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.4 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 43.6 t-80 -60.66 -52.69 64.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 70' ' ' GLU . 4.5 pp -72.04 -33.74 68.22 Favored 'General case' 0 C--O 1.264 1.848 0 CA-C-O 121.305 0.574 . . . . 0.0 111.969 -175.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.834 HD21 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -70.76 -36.5 73.13 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 179.2 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.549 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -60.94 -39.87 91.08 Favored 'General case' 0 C--O 1.188 -2.151 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.316 175.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.499 ' HB2' ' O ' ' A' ' 67' ' ' LEU . 42.5 mm-40 -55.77 -51.37 67.64 Favored 'General case' 0 C--O 1.253 1.282 0 C-N-CA 122.697 0.399 . . . . 0.0 111.704 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.81 -39.01 76.79 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 118.63 -1.228 . . . . 0.0 111.924 -177.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.549 HG22 ' HA ' ' A' ' 69' ' ' ALA . 8.4 tt -67.65 -45.19 85.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.662 -179.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.556 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 47.7 t80 -54.95 -51.88 64.75 Favored 'General case' 0 C--O 1.252 1.204 0 C-N-CA 125.571 1.548 . . . . 0.0 110.684 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.405 ' NZ ' ' HB3' ' A' ' 74' ' ' LYS . 0.4 OUTLIER -63.21 -41.22 99.12 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 120.471 -0.492 . . . . 0.0 110.53 -179.387 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.401 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.3 mp -62.83 -35.05 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 O-C-N 123.177 0.298 . . . . 0.0 111.45 178.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.525 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 5.1 mt-30 -70.75 -44.29 67.08 Favored 'General case' 0 CA--C 1.483 -1.634 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.867 -177.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.556 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 12.4 ptpt -74.55 -27.4 60.5 Favored 'General case' 0 N--CA 1.418 -2.027 0 C-N-CA 119.017 -1.073 . . . . 0.0 111.898 176.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.459 ' HG2' HD13 ' B' ' 111' ' ' LEU . 25.4 tt0 -67.46 -42.71 82.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 176.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.64 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.5 pp -65.98 -39.34 90.27 Favored 'General case' 0 C--O 1.212 -0.878 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.088 177.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -58.4 -52.72 64.44 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 123.726 0.641 . . . . 0.0 111.111 176.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.415 ' HG2' ' HA ' ' A' ' 78' ' ' GLU . 10.8 pt-20 -64.41 -43.23 95.02 Favored 'General case' 0 C--O 1.211 -0.926 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.982 -178.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.409 ' C ' ' HD2' ' A' ' 82' ' ' LYS . 0.2 OUTLIER -67.4 -33.47 75.25 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.122 0.486 . . . . 0.0 110.677 -177.799 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -75.12 -45.46 40.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.622 -179.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -80.76 -60.34 2.34 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 -176.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.3 p 175.65 84.04 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -175.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -94.97 -23.82 17.22 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 119.279 -0.968 . . . . 0.0 109.547 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--O 1.254 1.304 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.833 175.734 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.872 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 14.7 m -87.88 111.94 21.97 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 114.549 -0.826 . . . . 0.0 109.342 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 89.4 mtp -81.14 -2.73 49.58 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.14 0.792 . . . . 0.0 113.14 -173.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 9.8 t -131.02 25.21 4.95 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.083 0.468 . . . . 0.0 109.99 -178.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -95.01 127.42 41.06 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.557 -0.857 . . . . 0.0 108.701 178.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 71.95 126.95 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.96 1.304 . . . . 0.0 111.382 -174.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.66 87.06 1.04 Allowed Glycine 0 N--CA 1.433 -1.546 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -175.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 10.7 t30 71.14 7.13 6.07 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 122.606 1.193 . . . . 0.0 110.182 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.431 ' HA ' ' HG2' ' B' ' 112' ' ' GLN . 27.3 mm-40 -76.44 -27.73 56.32 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.089 -178.157 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 10.1 t -69.12 -30.24 68.46 Favored 'General case' 0 N--CA 1.428 -1.559 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . 0.459 HD13 ' HG2' ' A' ' 78' ' ' GLU . 56.9 tp -74.47 -47.8 31.19 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.566 0.222 . . . . 0.0 110.827 178.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.431 ' HG2' ' HA ' ' B' ' 109' ' ' GLN . 18.5 pt20 -71.14 -31.66 68.01 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 119.408 -0.917 . . . . 0.0 112.132 -178.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -70.21 -35.15 73.71 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.64 HD21 ' HB3' ' A' ' 79' ' ' LEU . 26.5 tp -66.07 -31.91 73.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.543 175.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 40.2 tp -70.12 -33.42 71.81 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 32.3 m -64.64 -43.09 94.8 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 174.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.408 ' HB3' ' HA ' ' A' ' 27' ' ' PHE . 17.6 m -61.58 -41.99 98.2 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 121.429 0.633 . . . . 0.0 109.761 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -56.64 -43.58 80.44 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 124.144 0.977 . . . . 0.0 110.788 176.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 23.5 t -68.25 -15.7 63.67 Favored 'General case' 0 CA--C 1.558 1.265 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.412 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 9.2 tt -89.23 -30.3 18.61 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 176.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 19.0 t -76.5 -47.46 22.71 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.845 -178.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 44.8 m80 75.86 -51.94 0.63 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.203 1.401 . . . . 0.0 112.404 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 20.5 t -108.46 165.5 11.47 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.98 -0.45 . . . . 0.0 110.064 -176.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -84.49 80.9 9.07 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -91.04 -102.8 1.27 Allowed Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.822 -176.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 82.91 -140.81 20.44 Favored Glycine 0 N--CA 1.436 -1.319 0 N-CA-C 111.784 -0.526 . . . . 0.0 111.784 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 158.66 -27.32 0.41 Allowed Glycine 0 C--N 1.304 -1.218 0 N-CA-C 109.997 -1.241 . . . . 0.0 109.997 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 5.1 t 78.33 -47.73 0.45 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.949 1.699 . . . . 0.0 111.056 175.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 95.44 110.32 2.44 Favored Glycine 0 N--CA 1.441 -1.03 0 C-N-CA 120.985 -0.626 . . . . 0.0 113.693 176.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -142.47 168.99 25.65 Favored Glycine 0 C--N 1.297 -1.591 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 99.31 44.08 2.43 Favored Glycine 0 C--N 1.301 -1.375 0 C-N-CA 120.524 -0.846 . . . . 0.0 111.526 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.9 p -71.23 137.83 48.98 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.639 0.257 . . . . 0.0 110.486 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -150.06 145.88 14.43 Favored Glycine 0 N--CA 1.431 -1.683 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 148.26 -142.97 10.51 Favored Glycine 0 N--CA 1.438 -1.224 0 C-N-CA 121.289 -0.481 . . . . 0.0 112.021 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -110.32 -115.45 3.65 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.128 -0.558 . . . . 0.0 114.129 -175.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 43.4 t -25.35 -75.84 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 126.776 2.03 . . . . 0.0 115.309 -174.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 67.0 mt -101.94 -15.39 16.85 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.918 0.866 . . . . 0.0 108.845 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.607 ' HG2' ' HB2' ' A' ' 14' ' ' LEU . 2.9 mt-10 -83.38 -16.24 46.74 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 113.565 -1.652 . . . . 0.0 112.003 -164.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 42.1 t -41.08 -59.78 1.39 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.139 1.376 . . . . 0.0 112.128 -176.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -169.93 83.94 0.12 Allowed 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 123.217 1.484 . . . . 0.0 107.867 173.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.409 ' HE2' ' HB ' ' B' ' 145' ' ' ILE . 16.0 ptm -92.72 -11.35 34.19 Favored 'General case' 0 C--N 1.291 -1.957 0 CA-C-N 114.025 -1.443 . . . . 0.0 111.157 -173.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -10.4 -74.18 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 128.196 2.598 . . . . 0.0 115.554 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 5.7 m -66.54 -47.48 72.74 Favored 'General case' 0 C--O 1.253 1.251 0 C-N-CA 123.589 0.756 . . . . 0.0 112.191 -175.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 62.5 mt -65.62 -44.49 93.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.887 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.409 ' HB ' ' HE2' ' B' ' 141' ' ' MET . 12.0 tt -67.49 -36.63 76.92 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.481 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.855 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 45.6 ttt180 -55.71 -50.5 70.14 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . 0.474 ' HA ' ' HB2' ' B' ' 151' ' ' ASP . 14.9 m -60.97 -51.86 67.46 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.651 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -76.52 -43.32 39.88 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -174.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.519 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 2.5 tm? -75.34 -42.69 53.76 Favored 'General case' 0 C--N 1.296 -1.741 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.721 -172.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.502 ' SD ' HD12 ' B' ' 149' ' ' LEU . 0.0 OUTLIER -161.29 33.12 0.14 Allowed 'General case' 0 C--O 1.247 0.968 0 N-CA-C 116.169 1.914 . . . . 0.0 116.169 -175.331 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . 0.474 ' HB2' ' HA ' ' B' ' 147' ' ' SER . 27.2 t70 -67.81 121.06 15.18 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 118.9 -1.12 . . . . 0.0 110.765 176.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.846 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.378 -178.392 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.488 -1.625 0 N-CA-C 111.888 -0.485 . . . . 0.0 111.888 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.409 ' HB ' ' NZ ' ' A' ' 4' ' ' LYS . 21.6 t -132.54 125.17 52.82 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.589 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 178.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.544 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -91.63 112.64 24.65 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 -178.021 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.453 ' HD2' ' HE1' ' A' ' 6' ' ' TRP . 28.8 mtmm -121.59 119.78 32.89 Favored 'General case' 0 C--N 1.28 -2.443 0 CA-C-N 114.531 -1.213 . . . . 0.0 108.578 -174.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -52.2 -25.1 17.56 Favored Glycine 0 C--O 1.243 0.709 0 N-CA-C 116.023 1.169 . . . . 0.0 116.023 -172.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.453 ' HE1' ' HD2' ' A' ' 4' ' ' LYS . 66.2 p-90 -66.59 -14.72 62.75 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 117.412 0.606 . . . . 0.0 112.009 178.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -59.39 -14.12 10.92 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 177.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -84.86 -10.26 57.31 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.46 0.648 . . . . 0.0 110.422 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -95.04 3.58 54.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.211 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.0 p -134.74 125.85 46.75 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.021 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.459 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -93.84 157.83 15.94 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.52 -177.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.413 HE21 ' HB3' ' A' ' 12' ' ' GLN . 0.0 OUTLIER -52.42 -43.05 64.6 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.071 0.948 . . . . 0.0 110.049 175.857 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.415 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 1.9 m-20 -57.47 -37.23 72.55 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.245 -0.888 . . . . 0.0 112.191 -179.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.479 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tm? -70.4 -51.45 29.48 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 -176.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.497 ' O ' HG23 ' A' ' 19' ' ' VAL . 3.9 ptm180 -66.17 -43.73 86.08 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.447 -1.251 . . . . 0.0 113.164 -176.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.5 t -68.42 -24.46 64.74 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-O 121.181 0.515 . . . . 0.0 109.672 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 20.2 t60 -68.92 -44.58 72.84 Favored 'General case' 0 C--O 1.246 0.915 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 176.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.766 HD23 HD21 ' A' ' 68' ' ' LEU . 3.7 mp -65.78 -40.65 92.2 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.705 -1.134 . . . . 0.0 110.171 177.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 15' ' ' ARG . 60.6 t -55.69 -48.46 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 123.602 0.761 . . . . 0.0 110.101 174.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -53.65 -50.43 65.78 Favored 'General case' 0 C--O 1.249 1.053 0 C-N-CA 123.622 0.769 . . . . 0.0 110.607 177.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.9 mttm -64.14 -39.8 94.8 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.814 178.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.522 ' O ' HG22 ' A' ' 26' ' ' ILE . 20.2 mt -50.96 -53.34 33.87 Favored 'General case' 0 CA--C 1.505 -0.782 0 O-C-N 123.797 0.686 . . . . 0.0 110.559 175.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.461 HG11 ' HE1' ' A' ' 40' ' ' MET . 54.7 t -54.8 -50.11 63.77 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.766 0 O-C-N 124.173 0.921 . . . . 0.0 110.786 176.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -55.34 -38.79 69.23 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -177.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.443 ' HB3' HG13 ' A' ' 72' ' ' ILE . . . -81.16 -44.56 17.7 Favored 'General case' 0 C--O 1.206 -1.235 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.834 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.597 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.22 -25.92 16.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.529 0.681 . . . . 0.0 110.725 -175.0 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.597 ' CD2' HG23 ' A' ' 26' ' ' ILE . 62.9 m-85 -128.54 91.51 43.41 Favored Pre-proline 0 C--N 1.293 -1.888 0 C-N-CA 123.858 0.863 . . . . 0.0 109.446 178.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.84 97.52 0.18 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 122.081 1.854 . . . . 0.0 110.172 177.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.6 t -69.73 138.37 88.17 Favored Pre-proline 0 N--CA 1.424 -1.762 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.512 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.53 -34.99 8.63 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 122.515 2.143 . . . . 0.0 111.376 178.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -142.92 150.84 54.58 Favored Pre-proline 0 CA--C 1.489 -1.381 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -65.82 -13.39 39.6 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 122.1 1.866 . . . . 0.0 112.088 175.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -86.4 -9.71 55.76 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.369 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.37 -8.77 59.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.378 1.085 . . . . 0.0 108.564 176.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.426 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.2 mt -85.6 1.57 48.61 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 114.033 -1.439 . . . . 0.0 110.291 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -133.32 20.07 4.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 122.2 1.0 . . . . 0.0 108.699 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.688 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 27.1 t70 -98.03 177.09 5.53 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.642 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.688 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -68.69 -29.03 67.38 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.725 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.582 ' O ' HD13 ' A' ' 43' ' ' LEU . 4.3 tpm_? -63.95 -34.45 78.0 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.653 ' HA ' HD22 ' A' ' 43' ' ' LEU . 5.9 tpp -58.54 -32.73 69.15 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 114.266 -1.334 . . . . 0.0 112.724 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.5 pt-20 -64.36 -31.61 72.89 Favored 'General case' 0 C--O 1.203 -1.358 0 C-N-CA 118.727 -1.189 . . . . 0.0 109.845 -178.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -72.77 -46.08 55.24 Favored 'General case' 0 CA--C 1.5 -0.949 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 175.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.653 HD22 ' HA ' ' A' ' 40' ' ' MET . 1.7 mp -53.19 -55.97 20.04 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 113.928 -1.487 . . . . 0.0 110.744 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.617 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 4.0 p -73.26 -29.08 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.034 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.571 -175.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.79 -47.67 84.78 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.534 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 3.0 t80 -61.15 -46.56 90.01 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.148 175.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.48 -44.45 93.04 Favored 'General case' 0 C--O 1.207 -1.15 0 C-N-CA 120.854 -0.339 . . . . 0.0 111.21 -177.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -62.83 -46.24 88.83 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 123.32 0.648 . . . . 0.0 111.829 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.5 pttp -63.55 -41.84 98.41 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-O 121.306 0.574 . . . . 0.0 110.605 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.512 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 50.8 t -70.47 -43.56 77.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.053 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -58.48 -44.6 89.4 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 177.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.7 -42.49 96.34 Favored Glycine 0 N--CA 1.44 -1.049 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.179 178.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.35 -54.62 44.66 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.491 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -67.02 -30.21 70.24 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 179.612 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.6 -50.74 63.98 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -69.4 -25.12 63.98 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.246 -0.434 . . . . 0.0 112.07 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.464 ' HB2' ' HA ' ' A' ' 54' ' ' MET . 34.5 m -79.18 -27.25 42.63 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 124.408 1.083 . . . . 0.0 113.431 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -88.19 162.82 16.47 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -110.71 8.32 22.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.54 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.6 p -162.49 157.97 23.02 Favored 'General case' 0 CA--C 1.487 -1.452 0 N-CA-C 107.52 -1.289 . . . . 0.0 107.52 174.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.1 -26.45 62.15 Favored 'General case' 0 C--O 1.2 -1.515 0 C-N-CA 118.921 -1.112 . . . . 0.0 110.131 178.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -64.72 -45.3 87.13 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.502 176.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -63.26 -44.56 94.81 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.022 175.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.63 -46.45 79.18 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.694 -177.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -61.86 -44.79 96.12 Favored 'General case' 0 C--O 1.209 -1.056 0 O-C-N 123.839 0.712 . . . . 0.0 110.318 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.479 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 13.8 t60 -65.46 -47.16 77.09 Favored 'General case' 0 C--O 1.209 -1.038 0 O-C-N 123.157 0.286 . . . . 0.0 111.475 -177.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.477 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.0 pp -70.5 -33.23 70.98 Favored 'General case' 0 C--O 1.255 1.381 0 C-N-CA 120.256 -0.578 . . . . 0.0 111.528 -176.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.766 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -73.23 -33.6 65.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 178.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.594 ' O ' ' HB2' ' A' ' 73' ' ' TYR . . . -63.7 -41.97 98.04 Favored 'General case' 0 C--O 1.183 -2.439 0 CA-C-N 114.896 -1.047 . . . . 0.0 108.906 175.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 38.3 mm-40 -57.11 -47.37 81.25 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-O 121.462 0.649 . . . . 0.0 111.314 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.504 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -70.23 -38.62 75.26 Favored 'General case' 0 N--CA 1.433 -1.294 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.908 -178.149 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.524 HG22 ' HA ' ' A' ' 69' ' ' ALA . 9.4 tt -69.68 -36.57 71.0 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-O 121.765 0.793 . . . . 0.0 109.794 -179.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.638 ' CD2' ' HA ' ' B' ' 150' ' ' MET . 16.9 t80 -58.55 -55.44 34.99 Favored 'General case' 0 C--O 1.279 2.646 0 C-N-CA 126.656 1.983 . . . . 0.0 109.826 -178.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.7 ptpt -64.87 -33.14 75.29 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.793 -178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -68.11 -41.79 84.51 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 O-C-N 123.481 0.488 . . . . 0.0 111.905 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.574 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 29.1 mt-30 -62.42 -49.01 77.17 Favored 'General case' 0 C--O 1.262 1.745 0 CA-C-O 121.198 0.523 . . . . 0.0 111.253 -178.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 14.2 ptpt -69.33 -31.18 69.46 Favored 'General case' 0 N--CA 1.434 -1.243 0 C-N-CA 118.75 -1.18 . . . . 0.0 111.848 178.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 11.4 tp10 -64.99 -47.53 77.19 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.602 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.5 pp -60.4 -43.72 96.41 Favored 'General case' 0 CA--C 1.492 -1.285 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.493 -177.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.427 ' N ' HD12 ' A' ' 79' ' ' LEU . 11.5 pt-20 -67.1 -39.15 86.66 Favored 'General case' 0 C--O 1.258 1.52 0 C-N-CA 119.35 -0.94 . . . . 0.0 112.214 -178.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -73.8 -39.26 64.23 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 119.892 -0.723 . . . . 0.0 112.211 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.493 ' C ' ' HD2' ' A' ' 82' ' ' LYS . 0.2 OUTLIER -73.44 -31.93 64.1 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 110.971 -179.429 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 -66.86 -40.65 87.94 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -77.72 -59.59 2.72 Favored 'General case' 0 N--CA 1.435 -1.222 0 C-N-CA 119.89 -0.724 . . . . 0.0 110.311 178.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.4 p -178.68 97.43 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -176.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -121.75 -26.1 4.93 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 171.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 C--O 1.246 0.907 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 177.245 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.805 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' B' ' 105' ' ' HIS . 33.0 t -124.47 110.67 14.79 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -178.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 91.1 mmm -89.88 -28.8 19.0 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.628 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 25.4 p -143.33 -50.19 0.33 Allowed 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.305 -177.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . 0.559 ' O ' ' HB3' ' B' ' 109' ' ' GLN . 39.5 t60 68.91 22.3 7.18 Favored 'General case' 0 C--N 1.35 0.629 0 CA-C-O 122.727 1.251 . . . . 0.0 108.267 -176.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -128.03 113.34 15.68 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 98.24 -30.81 8.83 Favored Glycine 0 C--N 1.301 -1.384 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -123.11 9.59 9.3 Favored 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -177.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.559 ' HB3' ' O ' ' B' ' 105' ' ' HIS . 4.6 pm0 -60.39 -37.93 82.35 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.169 0.509 . . . . 0.0 110.077 -179.442 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 12.8 t -70.82 -34.48 71.75 Favored 'General case' 0 N--CA 1.416 -2.128 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.283 -173.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -66.71 -45.02 80.1 Favored 'General case' 0 CA--C 1.51 -0.586 0 C-N-CA 121.1 -0.24 . . . . 0.0 111.094 178.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -75.41 -35.53 60.99 Favored 'General case' 0 N--CA 1.441 -0.91 0 C-N-CA 119.771 -0.771 . . . . 0.0 112.465 -178.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -63.92 -45.59 88.57 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.586 175.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 79' ' ' LEU . 58.3 tp -63.13 -36.67 84.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.157 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 35.0 tp -70.69 -31.05 67.8 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 89.9 m -67.44 -43.04 82.13 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 175.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.555 ' O ' ' HG ' ' B' ' 120' ' ' LEU . 15.0 m -57.98 -46.37 85.28 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.708 0.765 . . . . 0.0 110.408 176.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -62.19 -42.64 99.47 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.745 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 38.0 t -64.97 -41.75 95.18 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.08 179.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' B' ' 117' ' ' SER . 3.7 pp -68.65 -33.2 73.59 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-O 120.794 0.331 . . . . 0.0 110.635 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 27.5 t -75.64 -41.7 53.45 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.845 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 18.9 t60 70.78 -67.0 0.27 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.442 1.497 . . . . 0.0 111.211 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 6.4 p -106.35 105.83 16.05 Favored 'General case' 0 N--CA 1.425 -1.683 0 CA-C-O 121.267 0.555 . . . . 0.0 110.19 -179.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -73.81 -176.5 2.45 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.563 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 169.27 -48.02 0.21 Allowed Glycine 0 N--CA 1.432 -1.604 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 98.92 -173.06 26.32 Favored Glycine 0 N--CA 1.435 -1.428 0 N-CA-C 110.333 -1.107 . . . . 0.0 110.333 -178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 164.96 143.09 3.6 Favored Glycine 0 N--CA 1.432 -1.598 0 C-N-CA 120.182 -1.008 . . . . 0.0 112.387 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 32.3 t -85.45 119.14 25.48 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -88.43 -111.29 1.12 Allowed Glycine 0 N--CA 1.437 -1.241 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.378 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -121.94 -102.43 1.73 Allowed Glycine 0 C--N 1.302 -1.351 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 100.76 84.62 1.81 Allowed Glycine 0 N--CA 1.434 -1.489 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.476 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 22.6 m -83.82 166.07 18.26 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 176.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . 0.414 ' HA2' ' HB3' ' A' ' 13' ' ' ASP . . . 169.23 163.59 23.52 Favored Glycine 0 N--CA 1.432 -1.626 0 C-N-CA 120.044 -1.074 . . . . 0.0 112.2 -178.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 129.04 25.96 0.94 Allowed Glycine 0 C--N 1.303 -1.302 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 177.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -106.97 -37.45 2.35 Favored Glycine 0 N--CA 1.422 -2.241 0 C-N-CA 120.868 -0.682 . . . . 0.0 113.081 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 36.6 t -140.09 -67.37 0.43 Allowed 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 -176.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 61.9 mt -105.72 -24.64 12.48 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 121.359 0.599 . . . . 0.0 110.402 -172.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.5 ' HA ' ' SD ' ' B' ' 141' ' ' MET . 1.1 mp0 -66.67 -19.32 65.74 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.95 -176.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 32.7 m -49.91 -47.49 52.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.703 1.601 . . . . 0.0 112.448 -177.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -136.3 74.99 1.52 Allowed 'General case' 0 CA--C 1.487 -1.478 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 174.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.5 ' SD ' ' HA ' ' B' ' 138' ' ' GLU . 5.0 ttt -103.32 -29.24 11.37 Favored 'General case' 0 C--O 1.168 -3.204 0 N-CA-C 114.52 1.304 . . . . 0.0 114.52 -168.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.481 ' CD ' ' H ' ' B' ' 142' ' ' GLU . 1.6 mp0 -30.14 -65.61 0.11 Allowed 'General case' 0 N--CA 1.503 2.176 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 -170.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 9.1 p -68.7 -37.97 79.94 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.407 0.622 . . . . 0.0 111.017 -177.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 42.7 mm -64.39 -48.05 86.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.94 -179.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.4 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 10.0 tp -65.6 -42.04 92.02 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.443 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.356 -176.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -62.78 -56.35 18.31 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 119.018 -1.073 . . . . 0.0 111.028 176.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 25.5 t -62.66 -50.93 69.24 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.519 -173.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -80.67 -37.02 31.58 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -174.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.585 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 2.3 tm? -77.74 -51.92 9.77 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 118.444 -0.788 . . . . 0.0 111.699 -175.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.638 ' HA ' ' CD2' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -172.99 129.99 0.49 Allowed 'General case' 0 C--N 1.366 1.311 0 C-N-CA 118.918 -1.113 . . . . 0.0 113.784 179.732 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -90.72 99.43 12.46 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 107.91 -1.145 . . . . 0.0 107.91 172.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.588 0 CA-C-N 114.197 -1.365 . . . . 0.0 107.401 -176.409 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.323 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.0 t -71.19 110.91 4.5 Favored 'Isoleucine or valine' 0 C--O 1.254 1.294 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.456 ' HD2' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -89.18 113.92 25.17 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 178.339 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -106.63 117.9 35.25 Favored 'General case' 0 C--N 1.274 -2.707 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 -174.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.21 -20.76 44.66 Favored Glycine 0 C--N 1.313 -0.721 0 O-C-N 124.045 0.841 . . . . 0.0 114.533 -174.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -69.58 -8.97 51.96 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 178.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -65.01 -20.4 66.48 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -80.85 -8.54 59.74 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.265 0.555 . . . . 0.0 110.431 178.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -103.54 5.15 36.52 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 121.464 0.649 . . . . 0.0 111.198 -176.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.8 HG22 ' HB3' ' A' ' 61' ' ' ARG . 0.9 OUTLIER -122.13 120.43 61.3 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.714 0 N-CA-C 105.132 -2.173 . . . . 0.0 105.132 175.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 1.5 m -74.6 149.7 39.96 Favored 'General case' 0 N--CA 1.407 -2.591 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.27 -38.18 85.83 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.07 -30.72 71.29 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.29 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.468 ' O ' HD13 ' A' ' 18' ' ' LEU . 2.7 tm? -75.45 -53.68 8.28 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.523 ' O ' HG23 ' A' ' 19' ' ' VAL . 7.2 ptm180 -56.44 -44.99 81.01 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 176.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.4 t -69.37 -25.86 64.38 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 121.291 -0.163 . . . . 0.0 110.912 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.471 ' CD2' ' HE2' ' A' ' 21' ' ' LYS . 30.6 t60 -70.38 -37.11 74.48 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.602 HD23 HD21 ' A' ' 68' ' ' LEU . 1.7 mp -66.13 -42.72 88.74 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.49 175.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.9 t -55.83 -50.72 66.69 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 123.896 0.878 . . . . 0.0 109.878 174.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -52.51 -47.15 66.82 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.738 176.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.471 ' HE2' ' CD2' ' A' ' 17' ' ' HIS . 61.4 mttm -66.98 -40.15 87.35 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.76 178.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.493 ' O ' HG22 ' A' ' 26' ' ' ILE . 64.9 mt -51.8 -51.06 59.2 Favored 'General case' 0 CA--C 1.506 -0.73 0 O-C-N 123.901 0.751 . . . . 0.0 110.252 175.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.645 HG11 ' HE1' ' A' ' 40' ' ' MET . 78.1 t -54.55 -53.14 33.87 Favored 'Isoleucine or valine' 0 C--O 1.186 -2.283 0 O-C-N 124.164 0.915 . . . . 0.0 110.258 176.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.418 ' HB3' ' HA2' ' B' ' 127' ' ' GLY . 0.0 OUTLIER -53.74 -36.41 62.29 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -176.545 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.48 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.79 -45.71 15.22 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 177.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.523 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -76.77 -26.37 16.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.832 0.825 . . . . 0.0 110.49 -174.698 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.523 ' CD2' HG23 ' A' ' 26' ' ' ILE . 50.6 m-85 -130.69 93.52 31.51 Favored Pre-proline 0 C--N 1.285 -2.23 0 C-N-CA 124.187 0.995 . . . . 0.0 109.877 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.438 ' CG ' ' HA ' ' B' ' 118' ' ' ASP . 35.9 Cg_endo -65.88 109.01 1.39 Allowed 'Trans proline' 0 C--O 1.249 1.027 0 C-N-CA 121.7 1.6 . . . . 0.0 109.904 176.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.4 t -76.07 140.14 69.71 Favored Pre-proline 0 N--CA 1.43 -1.426 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.196 -174.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -72.21 -36.2 5.89 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.336 2.024 . . . . 0.0 111.101 176.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -146.97 146.3 25.48 Favored Pre-proline 0 C--N 1.313 -1.001 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 -176.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.41 ' HA ' ' CD1' ' A' ' 35' ' ' LEU . 9.9 Cg_endo -55.39 -24.11 41.59 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 122.413 2.076 . . . . 0.0 114.132 175.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.47 -11.49 59.85 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.082 -1.011 . . . . 0.0 111.856 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.0 -9.15 58.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.665 0.745 . . . . 0.0 109.557 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 40' ' ' MET . 18.1 mt -90.15 -5.55 56.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.085 -0.962 . . . . 0.0 110.39 -178.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -133.81 33.16 3.47 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.648 ' OD2' ' HD3' ' A' ' 38' ' ' ARG . 32.5 t70 -112.13 176.59 4.96 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 113.76 -1.564 . . . . 0.0 110.65 -173.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.648 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.28 -25.59 62.51 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-O 121.196 0.522 . . . . 0.0 110.635 176.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.554 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 5.2 tpm_? -71.15 -30.83 66.94 Favored 'General case' 0 C--O 1.252 1.219 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 176.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.814 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.5 tpp -58.25 -39.91 80.39 Favored 'General case' 0 C--O 1.197 -1.66 0 CA-C-N 114.483 -1.235 . . . . 0.0 112.683 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 10.9 pt-20 -59.05 -30.38 68.01 Favored 'General case' 0 C--O 1.205 -1.281 0 C-N-CA 119.521 -0.871 . . . . 0.0 110.919 -177.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.438 HD22 HD23 ' A' ' 43' ' ' LEU . 4.5 t30 -74.77 -46.18 38.77 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.287 0.565 . . . . 0.0 109.902 176.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.2 mt -60.2 -51.14 70.86 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.715 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.814 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 5.3 p -71.88 -27.88 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.646 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.376 -178.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.49 -46.68 86.19 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.523 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 7.5 t80 -59.76 -47.1 87.02 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.4 174.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.49 97.83 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 120.369 -0.533 . . . . 0.0 111.306 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -65.14 -45.81 83.49 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 123.206 0.602 . . . . 0.0 111.34 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.523 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 56.5 pttt -63.71 -38.04 89.63 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-O 121.726 0.774 . . . . 0.0 110.321 -178.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.494 HG21 ' CE1' ' A' ' 46' ' ' TYR . 39.9 t -73.82 -42.84 53.9 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.225 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.134 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.429 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 15.0 tm-20 -58.6 -44.4 89.88 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.55 -43.51 97.55 Favored Glycine 0 CA--C 1.501 -0.783 0 O-C-N 123.626 0.579 . . . . 0.0 111.949 177.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -55.48 -54.36 44.79 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 123.025 0.53 . . . . 0.0 111.718 177.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.48 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -70.76 -29.77 66.09 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -64.64 -49.84 69.43 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 177.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -76.33 -14.23 60.11 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.22 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.1 t -86.77 -17.72 32.84 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.848 0.356 . . . . 0.0 110.106 176.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -97.43 171.81 8.16 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-O 121.225 0.536 . . . . 0.0 112.045 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -124.02 14.6 9.18 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.723 178.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 82.5 p -167.9 156.59 9.29 Favored 'General case' 0 CA--C 1.486 -1.505 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 175.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.8 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -67.36 -31.32 71.49 Favored 'General case' 0 C--O 1.189 -2.128 0 C-N-CA 118.691 -1.204 . . . . 0.0 109.625 175.03 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -58.78 -47.88 83.18 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 123.725 0.641 . . . . 0.0 110.499 178.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -65.96 -45.12 82.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.57 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.421 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -66.11 -46.46 77.51 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.856 -176.463 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -60.62 -44.29 96.5 Favored 'General case' 0 C--O 1.204 -1.323 0 C-N-CA 123.831 0.852 . . . . 0.0 109.283 177.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.471 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 7.4 t60 -58.88 -57.32 13.58 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 123.261 0.624 . . . . 0.0 110.925 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.476 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.2 pp -68.03 -33.21 74.16 Favored 'General case' 0 C--O 1.258 1.537 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -173.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.602 HD21 HD23 ' A' ' 18' ' ' LEU . 0.8 OUTLIER -72.34 -37.78 68.78 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 179.573 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.597 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -60.39 -40.11 89.72 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.552 176.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 55.7 mm-40 -60.78 -46.11 91.75 Favored 'General case' 0 C--O 1.252 1.208 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.01 178.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -42.5 75.3 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 118.769 -1.172 . . . . 0.0 111.23 -178.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.518 HG22 ' HA ' ' A' ' 69' ' ' ALA . 5.5 tt -63.13 -42.26 95.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.751 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -57.19 -52.97 63.18 Favored 'General case' 0 C--O 1.274 2.366 0 C-N-CA 125.054 1.342 . . . . 0.0 110.379 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.6 -32.06 73.44 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.571 -178.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.48 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -68.1 -37.12 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 C-N-CA 123.007 0.523 . . . . 0.0 111.11 178.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.565 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 34.9 mt-30 -65.59 -45.67 82.3 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 121.189 0.519 . . . . 0.0 110.751 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.541 ' HB3' ' HZ3' ' A' ' 77' ' ' LYS . 0.3 OUTLIER -70.32 -27.88 64.72 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 118.472 -1.291 . . . . 0.0 113.034 175.605 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -63.44 -48.42 77.81 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 175.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.6 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.7 pp -62.9 -40.46 97.64 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.06 -178.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.433 ' N ' HD12 ' A' ' 79' ' ' LEU . 0.7 OUTLIER -60.39 -53.33 58.9 Favored 'General case' 0 N--CA 1.412 -2.344 0 O-C-N 123.956 0.785 . . . . 0.0 110.467 -179.61 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -72.35 -33.17 67.09 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 118.982 -1.087 . . . . 0.0 112.54 -175.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.426 ' HE3' ' CG ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -67.21 -34.14 76.87 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.396 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -77.98 -40.54 38.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.713 178.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 -87.41 -57.94 2.77 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -171.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 66.4 m -155.28 98.9 2.03 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.471 ' HG3' ' HG ' ' A' ' 87' ' ' LEU . 4.5 ptp180 176.15 -31.66 0.0 OUTLIER 'General case' 0 C--O 1.209 -1.071 0 C-N-CA 126.639 1.975 . . . . 0.0 109.313 170.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.471 ' HG ' ' HG3' ' A' ' 86' ' ' ARG . 36.2 mt . . . . . 0 C--O 1.243 0.738 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.448 -177.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.679 0 CA-C-O 121.881 0.712 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 20.3 m -132.64 90.71 2.81 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-O 121.116 0.484 . . . . 0.0 110.273 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 25.2 mmt -120.85 -30.42 4.43 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.886 177.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 19.8 m -85.09 -43.88 13.5 Favored 'General case' 0 N--CA 1.435 -1.224 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.777 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -97.65 89.3 4.6 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-O 122.323 1.058 . . . . 0.0 108.272 174.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . 0.456 ' HA ' ' CG ' ' B' ' 109' ' ' GLN . 84.8 m-85 72.62 165.92 0.3 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 113.557 -1.656 . . . . 0.0 111.25 -172.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 95.44 -83.73 0.89 Allowed Glycine 0 C--N 1.304 -1.226 0 N-CA-C 110.657 -0.977 . . . . 0.0 110.657 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.408 ' O ' ' HG2' ' B' ' 112' ' ' GLN . 14.2 m120 -96.37 62.92 2.11 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 177.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.456 ' CG ' ' HA ' ' B' ' 106' ' ' TYR . 23.9 mm-40 -82.4 -35.7 27.44 Favored 'General case' 0 CA--C 1.481 -1.687 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.374 -178.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 19.3 p -61.08 -36.53 79.89 Favored 'General case' 0 C--O 1.2 -1.536 0 O-C-N 123.969 0.793 . . . . 0.0 110.269 178.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 61.1 tp -58.73 -43.83 90.29 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 122.951 0.5 . . . . 0.0 110.733 176.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 108' ' ' ASN . 47.1 mm-40 -66.54 -50.63 62.54 Favored 'General case' 0 C--O 1.252 1.22 0 CA-C-O 121.417 0.627 . . . . 0.0 109.358 -177.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -60.89 -48.18 83.01 Favored 'General case' 0 C--O 1.212 -0.869 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.723 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.6 HD21 ' HB3' ' A' ' 79' ' ' LEU . 36.9 tp -69.65 -20.51 63.58 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.908 -176.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.0 tp -74.89 -44.36 49.27 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 173.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.484 ' O ' ' HB3' ' B' ' 119' ' ' SER . 42.2 m -68.9 -36.68 78.33 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 114.506 -1.224 . . . . 0.0 111.062 -179.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.546 ' OG ' ' HA ' ' B' ' 114' ' ' LEU . 68.2 p -75.95 -34.98 59.85 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.011 0.434 . . . . 0.0 110.108 178.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 20.6 t70 -59.01 -36.58 75.18 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.597 0.713 . . . . 0.0 109.409 175.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . 0.484 ' HB3' ' O ' ' B' ' 116' ' ' THR . 38.1 t -57.83 -11.04 1.97 Allowed 'General case' 0 CA--C 1.561 1.375 0 CA-C-N 114.009 -1.451 . . . . 0.0 112.581 178.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 67.4 tp -62.74 -62.42 1.75 Allowed 'General case' 0 C--N 1.347 0.477 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 174.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 33.5 t -77.26 -28.09 53.4 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 29.2 t60 84.96 -57.7 0.09 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 126.644 1.977 . . . . 0.0 109.674 -177.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 19.0 p -169.81 75.87 0.09 Allowed 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 176.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -176.64 145.22 0.53 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.715 0.406 . . . . 0.0 110.094 174.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . 88.42 -123.52 6.79 Favored Glycine 0 N--CA 1.429 -1.814 0 N-CA-C 109.866 -1.294 . . . . 0.0 109.866 -179.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 126.26 -125.89 5.6 Favored Glycine 0 N--CA 1.427 -1.943 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.676 179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . 0.418 ' HA2' ' HB3' ' A' ' 24' ' ' GLN . . . -101.55 -154.15 26.07 Favored Glycine 0 N--CA 1.427 -1.924 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.12 -179.067 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 33.0 t -156.21 137.72 14.04 Favored 'General case' 0 N--CA 1.429 -1.524 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -90.45 -169.5 43.09 Favored Glycine 0 N--CA 1.432 -1.579 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.412 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 78.9 178.9 51.2 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.245 177.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -155.54 153.19 24.58 Favored Glycine 0 N--CA 1.438 -1.231 0 N-CA-C 108.624 -1.791 . . . . 0.0 108.624 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 46.9 m -141.33 138.01 32.8 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 117.987 0.894 . . . . 0.0 110.534 -177.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 142.72 174.44 15.12 Favored Glycine 0 N--CA 1.43 -1.701 0 C-N-CA 120.922 -0.656 . . . . 0.0 113.044 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -152.33 135.67 5.07 Favored Glycine 0 N--CA 1.438 -1.19 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 176.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 142.68 -129.08 3.68 Favored Glycine 0 N--CA 1.435 -1.401 0 C-N-CA 120.204 -0.998 . . . . 0.0 112.512 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 2.7 p -62.42 -70.82 0.18 Allowed 'General case' 0 CA--C 1.556 1.195 0 N-CA-C 115.456 1.65 . . . . 0.0 115.456 -174.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 65.7 mt -106.26 -27.73 10.85 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 122.069 0.938 . . . . 0.0 109.078 -177.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -73.45 -12.0 60.65 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 114.146 -1.388 . . . . 0.0 114.051 -175.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 6.9 p -55.44 -60.46 3.39 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -178.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -120.99 85.11 2.34 Favored 'General case' 0 CA--C 1.477 -1.841 0 N-CA-C 104.325 -2.472 . . . . 0.0 104.325 173.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.485 ' O ' HG12 ' B' ' 145' ' ' ILE . 19.4 ttt -93.45 -38.79 11.25 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 114.189 -1.369 . . . . 0.0 112.66 -164.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' B' ' 146' ' ' ARG . 41.3 mt-10 -55.61 -42.25 74.62 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -174.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 13.4 p -59.26 -51.65 69.06 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.36 0.6 . . . . 0.0 110.722 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 41.1 mt -67.3 -47.54 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.686 -177.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.485 HG12 ' O ' ' B' ' 141' ' ' MET . 40.4 pt -66.32 -31.19 52.5 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.141 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.535 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 91.2 mtt180 -68.97 -53.15 22.3 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 118.423 -1.311 . . . . 0.0 108.883 177.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 47.6 t -60.67 -54.96 38.92 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.403 -177.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -82.4 -41.49 19.85 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 -178.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.597 ' HA ' ' HB1' ' A' ' 69' ' ' ALA . 9.4 tt -97.59 -34.29 11.02 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -166.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 22.7 ptt? -169.36 127.82 0.98 Allowed 'General case' 0 C--O 1.242 0.671 0 CA-C-O 123.24 1.495 . . . . 0.0 114.203 -176.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -107.8 -59.82 1.79 Allowed 'General case' 0 C--N 1.271 -2.841 0 CA-C-N 112.539 -2.118 . . . . 0.0 108.325 -177.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.66 0 N-CA-C 101.366 -3.568 . . . . 0.0 101.366 -179.843 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.094 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.7 m -89.84 104.54 15.23 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 122.452 1.12 . . . . 0.0 113.019 -178.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.505 ' HD3' ' H ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -109.25 93.76 4.68 Favored 'General case' 0 C--N 1.283 -2.293 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.544 177.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.433 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 9.9 ptpt -143.41 103.62 4.13 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.906 -1.497 . . . . 0.0 109.999 -174.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -48.57 -20.16 1.55 Allowed Glycine 0 N--CA 1.484 1.85 0 N-CA-C 117.121 1.608 . . . . 0.0 117.121 -170.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.433 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 67.2 p-90 -67.84 -16.51 64.13 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 117.462 0.631 . . . . 0.0 111.798 179.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -67.72 -9.91 47.86 Favored 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -89.47 -8.05 53.72 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.417 0.627 . . . . 0.0 109.663 176.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.3 m-70 -100.04 3.08 43.92 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.634 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.0 p -135.27 113.82 15.97 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.997 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 -177.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 m -96.28 163.75 12.95 Favored 'General case' 0 N--CA 1.419 -2.01 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -176.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.16 -36.43 40.95 Favored 'General case' 0 C--O 1.213 -0.827 0 C-N-CA 124.325 1.05 . . . . 0.0 111.498 179.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -55.42 -44.81 76.59 Favored 'General case' 0 C--N 1.308 -1.226 0 C-N-CA 123.257 0.623 . . . . 0.0 111.807 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.49 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.0 tm? -70.23 -51.14 33.03 Favored 'General case' 0 CA--C 1.492 -1.281 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -175.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.551 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.6 ptm180 -65.52 -40.99 93.59 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 114.505 -1.225 . . . . 0.0 113.091 -175.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.2 t -68.18 -28.33 67.18 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -66.5 -43.0 86.53 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.78 HD23 HD21 ' A' ' 68' ' ' LEU . 5.1 mp -67.38 -40.61 85.7 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.033 177.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 15' ' ' ARG . 65.2 t -57.6 -49.21 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.7 0.8 . . . . 0.0 110.095 175.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -54.49 -45.1 73.17 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.309 177.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.4 mttm -68.55 -38.32 80.68 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.315 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.475 ' O ' HG22 ' A' ' 26' ' ' ILE . 65.8 mt -54.07 -46.58 72.05 Favored 'General case' 0 C--O 1.214 -0.787 0 O-C-N 123.661 0.601 . . . . 0.0 109.589 174.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.664 HG11 ' HE1' ' A' ' 40' ' ' MET . 46.8 t -55.28 -53.43 35.29 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.559 0 O-C-N 124.003 0.815 . . . . 0.0 110.833 174.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -57.32 -30.69 64.99 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.499 ' CB ' HG13 ' A' ' 72' ' ' ILE . . . -82.77 -46.91 12.54 Favored 'General case' 0 C--O 1.203 -1.372 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 174.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.481 HG13 ' CE1' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -73.32 -26.57 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 121.799 0.809 . . . . 0.0 110.068 -174.819 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -131.53 91.89 33.11 Favored Pre-proline 0 N--CA 1.405 -2.721 0 C-N-CA 124.438 1.095 . . . . 0.0 108.594 176.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -63.64 93.3 0.17 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.725 1.617 . . . . 0.0 109.202 176.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.415 HG21 HD21 ' A' ' 35' ' ' LEU . 4.8 t -65.82 130.05 94.41 Favored Pre-proline 0 N--CA 1.415 -2.18 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.567 -172.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.477 ' HG2' ' OD1' ' A' ' 31' ' ' ASP . 41.8 Cg_endo -73.64 -31.63 8.46 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.588 2.192 . . . . 0.0 111.085 178.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.477 ' OD1' ' HG2' ' A' ' 30' ' ' PRO . 6.3 p-10 -144.18 155.4 58.24 Favored Pre-proline 0 N--CA 1.427 -1.622 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.429 -175.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.53 ' HA ' HD12 ' A' ' 35' ' ' LEU . 72.5 Cg_endo -75.66 -5.23 16.26 Favored 'Trans proline' 0 N--CA 1.45 -1.068 0 C-N-CA 121.77 1.647 . . . . 0.0 113.351 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -88.54 -24.68 22.84 Favored 'General case' 0 N--CA 1.434 -1.25 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.542 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.93 -21.09 63.07 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 122.038 0.923 . . . . 0.0 109.831 172.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.53 HD12 ' HA ' ' A' ' 32' ' ' PRO . 45.2 mt -80.05 -8.44 59.37 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.443 -1.253 . . . . 0.0 111.24 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -134.2 21.93 3.76 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.215 0.531 . . . . 0.0 109.927 178.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.412 ' O ' ' HB3' ' A' ' 40' ' ' MET . 20.5 t70 -90.11 178.02 6.29 Favored 'General case' 0 N--CA 1.422 -1.862 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.774 ' HD2' ' N ' ' A' ' 39' ' ' ARG . 2.3 ppt_? -63.75 -28.9 70.2 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.774 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 4.5 tpm_? -70.18 -30.19 67.25 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.032 -175.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.726 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 6.7 tpp -57.72 -32.17 67.15 Favored 'General case' 0 C--O 1.201 -1.452 0 CA-C-N 114.231 -1.35 . . . . 0.0 112.086 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -61.42 -29.83 70.18 Favored 'General case' 0 C--O 1.18 -2.594 0 C-N-CA 118.111 -1.436 . . . . 0.0 110.918 -179.445 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.43 HD22 HD12 ' A' ' 43' ' ' LEU . 2.6 t30 -75.48 -46.66 31.14 Favored 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 124.024 0.828 . . . . 0.0 109.088 176.032 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 39' ' ' ARG . 5.2 mp -51.63 -56.94 10.72 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 114.299 -1.319 . . . . 0.0 109.894 179.275 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.726 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -73.29 -28.2 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.59 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.517 -177.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' A' ' 41' ' ' GLU . . . -61.53 -43.24 99.22 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.546 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 1.9 t80 -65.81 -47.08 76.26 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.61 174.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.44 -40.91 88.32 Favored 'General case' 0 C--O 1.2 -1.51 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.829 -176.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.7 -43.07 80.94 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.612 0.765 . . . . 0.0 111.997 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.546 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 57.0 pttt -67.04 -40.25 87.12 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.399 0.619 . . . . 0.0 109.708 -178.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.448 HG21 ' CE2' ' A' ' 46' ' ' TYR . 45.7 t -71.53 -47.26 59.23 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.668 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -57.73 -45.65 85.52 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.91 -44.39 94.45 Favored Glycine 0 N--CA 1.436 -1.349 0 O-C-N 124.236 0.96 . . . . 0.0 111.768 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -58.72 -54.19 49.86 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.478 ' SD ' ' HB2' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -65.26 -35.21 80.31 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 178.768 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -62.91 -50.88 69.1 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.644 0.735 . . . . 0.0 109.34 177.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.78 -21.75 61.68 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.163 -178.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.7 t -85.28 -42.8 14.3 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -178.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.05 163.52 14.63 Favored 'General case' 0 C--O 1.244 0.797 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -109.05 2.82 21.46 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.583 -178.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.419 ' HB3' ' OD1' ' A' ' 62' ' ' ASP . 48.7 m -161.44 154.29 20.69 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 176.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.58 -34.53 74.28 Favored 'General case' 0 C--O 1.196 -1.757 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.184 -178.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.419 ' OD1' ' HB3' ' A' ' 60' ' ' SER . 4.9 p-10 -65.12 -35.83 82.36 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -66.82 -47.84 70.78 Favored 'General case' 0 N--CA 1.455 -0.175 0 O-C-N 123.487 0.492 . . . . 0.0 110.564 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -45.1 89.94 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.252 -177.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -60.65 -46.01 91.92 Favored 'General case' 0 C--O 1.19 -2.063 0 O-C-N 123.978 0.799 . . . . 0.0 109.719 176.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.555 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 28.7 t-80 -60.05 -55.05 38.7 Favored 'General case' 0 C--O 1.208 -1.104 0 O-C-N 123.194 0.309 . . . . 0.0 111.581 -178.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.455 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.1 pp -65.74 -32.55 74.16 Favored 'General case' 0 C--O 1.262 1.746 0 CA-C-O 120.965 0.412 . . . . 0.0 111.47 -175.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.78 HD21 HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -75.09 -35.83 61.75 Favored 'General case' 0 N--CA 1.443 -0.79 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.362 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.633 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.11 -34.84 78.47 Favored 'General case' 0 C--O 1.203 -1.347 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.736 176.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.555 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 17.2 mt-10 -69.43 -42.53 74.86 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.467 178.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -67.9 -38.82 83.47 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.393 -0.923 . . . . 0.0 110.891 179.231 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.633 HG22 ' HA ' ' A' ' 69' ' ' ALA . 5.9 tt -66.2 -48.37 81.48 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.853 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.548 177.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.454 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 8.3 t80 -51.71 -51.39 56.4 Favored 'General case' 0 C--O 1.269 2.116 0 C-N-CA 124.949 1.3 . . . . 0.0 111.837 178.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.528 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 17.8 ptpt -65.03 -38.8 92.06 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.884 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.487 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.4 mp -64.42 -37.06 79.03 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.654 0 O-C-N 123.557 0.536 . . . . 0.0 111.124 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.663 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.2 mm-40 -59.65 -55.38 35.17 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 122.085 0.945 . . . . 0.0 109.454 178.479 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 73' ' ' TYR . 1.2 ptpm? -70.19 -27.66 64.68 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.572 178.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.528 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 6.3 tp10 -63.67 -45.84 88.28 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 176.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.7 pp -64.79 -44.83 88.7 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.874 -177.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.464 ' N ' HD12 ' A' ' 79' ' ' LEU . 7.1 pt-20 -68.67 -44.63 73.65 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 119.364 -0.934 . . . . 0.0 112.65 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.6 -40.06 95.73 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.421 -0.511 . . . . 0.0 110.813 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.66 -29.83 62.56 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.403 -178.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -76.82 -42.66 39.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.035 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -90.12 -59.14 2.27 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.349 -0.54 . . . . 0.0 112.396 -173.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 35.8 t -175.71 105.23 0.08 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 120.955 0.407 . . . . 0.0 110.443 -174.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.498 ' HG3' HD12 ' A' ' 87' ' ' LEU . 14.3 ptm180 -121.76 -24.47 5.26 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 173.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.498 HD12 ' HG3' ' A' ' 86' ' ' ARG . 6.6 mp . . . . . 0 C--O 1.244 0.785 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 176.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . 0.459 ' N ' ' HG ' ' B' ' 104' ' ' SER . . . . . . . . 0 C--O 1.243 0.673 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 7.8 p -61.12 -41.53 96.88 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.537 0.684 . . . . 0.0 111.029 -178.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 22.0 ptm -71.5 -6.43 40.45 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.36 -0.837 . . . . 0.0 112.073 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . 0.459 ' HG ' ' N ' ' B' ' 101' ' ' GLY . 5.4 m -105.32 -53.51 2.64 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 36.2 m80 -87.57 -12.81 44.63 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.727 -173.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . 0.445 ' HA ' HE21 ' B' ' 109' ' ' GLN . 16.9 t80 -137.48 20.75 2.93 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 122.212 1.005 . . . . 0.0 108.828 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -139.45 74.2 0.39 Allowed Glycine 0 N--CA 1.436 -1.345 0 N-CA-C 110.093 -1.203 . . . . 0.0 110.093 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 63.65 76.9 0.34 Allowed 'General case' 0 C--O 1.245 0.841 0 C-N-CA 124.273 1.029 . . . . 0.0 109.266 -174.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.445 HE21 ' HA ' ' B' ' 106' ' ' TYR . 18.9 mp0 -62.81 -50.93 69.05 Favored 'General case' 0 CA--C 1.505 -0.78 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.003 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 5.2 t -68.11 -35.23 77.8 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -168.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 58.8 tp -69.51 -41.67 75.72 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.269 0.941 . . . . 0.0 110.763 -178.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.431 ' NE2' ' HA ' ' B' ' 104' ' ' SER . 21.4 mt-30 -75.52 -34.02 60.77 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.539 -177.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -64.66 -46.83 80.81 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.86 0.838 . . . . 0.0 109.266 174.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.612 HD21 ' HB3' ' A' ' 79' ' ' LEU . 47.7 tp -65.55 -28.47 69.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.128 179.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 46.4 tp -69.58 -37.72 77.09 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 18.2 m -63.56 -41.35 98.41 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 14.3 m -63.94 -46.67 83.69 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.417 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -61.27 -29.58 69.94 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 125.117 1.367 . . . . 0.0 111.135 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 8.9 t -67.53 -28.82 68.13 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.107 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 9.9 tt -83.17 -24.01 32.66 Favored 'General case' 0 N--CA 1.436 -1.154 0 C-N-CA 123.096 0.558 . . . . 0.0 110.209 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 19.6 m -62.16 -36.32 81.48 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.821 -179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 68.56 -63.07 0.36 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.054 0.942 . . . . 0.0 111.134 -178.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 14.5 m -98.02 172.08 7.85 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.28 99.43 1.18 Allowed 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -90.06 175.2 41.29 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.195 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 172.72 -161.06 32.33 Favored Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -170.25 156.99 28.04 Favored Glycine 0 N--CA 1.434 -1.443 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 50.0 m -139.21 173.79 11.18 Favored 'General case' 0 C--N 1.29 -1.992 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 179.21 179.72 48.76 Favored Glycine 0 N--CA 1.429 -1.785 0 C-N-CA 120.14 -1.029 . . . . 0.0 111.978 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . 104.1 135.85 8.66 Favored Glycine 0 N--CA 1.431 -1.691 0 N-CA-C 110.391 -1.084 . . . . 0.0 110.391 -178.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -108.96 -140.29 8.97 Favored Glycine 0 N--CA 1.421 -2.313 0 N-CA-C 109.079 -1.609 . . . . 0.0 109.079 176.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.0 t -140.03 75.98 1.54 Allowed 'General case' 0 N--CA 1.418 -2.039 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 173.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -165.27 51.86 0.27 Allowed Glycine 0 N--CA 1.429 -1.783 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 176.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -61.02 87.99 0.03 OUTLIER Glycine 0 C--O 1.241 0.567 0 O-C-N 124.644 0.85 . . . . 0.0 113.872 -176.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . 179.92 131.13 1.59 Allowed Glycine 0 N--CA 1.416 -2.648 0 N-CA-C 108.212 -1.955 . . . . 0.0 108.212 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 34.2 m 71.1 108.79 0.06 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.629 0.772 . . . . 0.0 110.48 -176.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.454 ' HA ' ' CG ' ' B' ' 141' ' ' MET . 1.8 pt? -40.67 -49.44 3.04 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.215 1.806 . . . . 0.0 114.965 -174.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.45 ' HB3' ' HB2' ' A' ' 14' ' ' LEU . 6.3 pt-20 -82.76 -12.83 57.23 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -177.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 46.4 t -83.81 -61.49 1.81 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . 0.408 ' OD2' ' HB2' ' B' ' 142' ' ' GLU . 33.2 t70 -173.12 130.76 0.48 Allowed 'General case' 0 CA--C 1.492 -1.259 0 C-N-CA 123.834 0.854 . . . . 0.0 108.886 176.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.587 ' HB2' ' HB ' ' B' ' 145' ' ' ILE . 64.0 mtm -103.36 -8.4 20.28 Favored 'General case' 0 C--N 1.28 -2.448 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -177.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.408 ' HB2' ' OD2' ' B' ' 140' ' ' ASP . 0.5 OUTLIER 29.4 -86.54 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 127.684 2.394 . . . . 0.0 114.432 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.53 -46.95 62.64 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.966 -172.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 47.3 mm -64.42 -47.97 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.223 0 CA-C-N 114.161 -1.381 . . . . 0.0 109.167 -177.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.587 ' HB ' ' HB2' ' B' ' 141' ' ' MET . 15.6 tt -70.01 -31.57 48.26 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.403 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.616 -176.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 27.6 ttm-85 -64.73 -60.6 2.92 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 19.3 p -66.78 -44.04 82.37 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -174.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -80.57 -38.83 28.79 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.478 ' HA ' ' HB1' ' A' ' 69' ' ' ALA 0.267 9.1 tt -91.17 -42.63 10.34 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -173.431 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -159.95 123.2 3.55 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 117.818 -1.553 . . . . 0.0 114.116 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -119.96 118.46 30.75 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 114.369 -1.287 . . . . 0.0 109.326 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.288 -2.079 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 178.074 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.483 -1.959 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 93.4 t 69.18 121.32 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.795 0 CA-C-O 121.889 0.852 . . . . 0.0 110.52 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.429 ' HD2' ' HA ' ' A' ' 3' ' ' ARG . 1.5 tpt180 -83.58 111.48 19.14 Favored 'General case' 0 N--CA 1.408 -2.57 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.096 -172.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.421 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 42.3 mttp -115.58 108.62 16.66 Favored 'General case' 0 N--CA 1.42 -1.975 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 178.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.461 ' O ' ' HG2' ' A' ' 8' ' ' GLU . . . -67.03 -3.92 25.56 Favored Glycine 0 C--N 1.31 -0.889 0 CA-C-N 115.838 -0.619 . . . . 0.0 114.263 -174.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.421 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 61.1 p-90 -78.76 -11.84 60.0 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 122.275 -0.544 . . . . 0.0 111.108 177.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -59.07 -26.56 64.73 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-O 121.267 0.556 . . . . 0.0 111.233 -178.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 5' ' ' GLY . 12.9 pt-20 -81.89 -4.11 55.77 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -176.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -104.52 2.78 31.24 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 120.973 0.416 . . . . 0.0 111.555 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.755 HG22 ' HB3' ' A' ' 61' ' ' ARG . 1.5 t -110.5 110.54 32.55 Favored 'Isoleucine or valine' 0 CA--C 1.487 -1.459 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.497 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER -68.9 151.55 46.42 Favored 'General case' 0 N--CA 1.412 -2.373 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -179.15 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -55.03 -41.65 71.62 Favored 'General case' 0 N--CA 1.426 -1.627 0 O-C-N 124.672 1.232 . . . . 0.0 108.796 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.487 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 10.9 m-20 -67.45 -30.52 70.28 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-O 118.866 -0.587 . . . . 0.0 112.534 179.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.531 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.4 tm? -73.68 -54.65 7.62 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' A' ' 11' ' ' THR . 1.6 ptm180 -55.14 -48.2 74.02 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 177.027 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.417 ' HA ' ' HB ' ' A' ' 19' ' ' VAL . 40.0 m -72.61 -21.13 61.17 Favored 'General case' 0 N--CA 1.426 -1.664 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.487 ' HB2' ' O ' ' A' ' 13' ' ' ASP . 10.5 t60 -67.89 -42.43 81.22 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 174.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.71 HD23 HD21 ' A' ' 68' ' ' LEU . 3.9 mp -69.84 -40.08 76.05 Favored 'General case' 0 C--N 1.306 -1.324 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.794 178.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 15' ' ' ARG . 53.2 t -55.8 -49.72 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 C-N-CA 123.559 0.744 . . . . 0.0 109.942 172.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -53.15 -50.38 64.66 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.264 1.026 . . . . 0.0 110.122 178.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -66.73 -38.14 86.08 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.046 179.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.493 ' O ' HG22 ' A' ' 26' ' ' ILE . 3.2 mt -51.02 -50.79 57.87 Favored 'General case' 0 CA--C 1.495 -1.152 0 O-C-N 123.924 0.765 . . . . 0.0 109.61 174.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.626 HG11 ' HE1' ' A' ' 40' ' ' MET . 57.8 t -55.56 -52.78 43.56 Favored 'Isoleucine or valine' 0 C--O 1.172 -2.999 0 O-C-N 124.336 1.023 . . . . 0.0 109.771 175.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -54.09 -33.29 57.21 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -175.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.549 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -82.01 -46.23 14.24 Favored 'General case' 0 C--O 1.207 -1.175 0 CA-C-O 121.505 0.669 . . . . 0.0 111.597 175.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.579 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -78.55 -23.69 13.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 CA-C-O 122.065 0.936 . . . . 0.0 110.84 -174.082 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.579 ' CD2' HG23 ' A' ' 26' ' ' ILE . 66.1 m-85 -135.31 95.26 14.86 Favored Pre-proline 0 C--N 1.279 -2.47 0 C-N-CA 125.057 1.343 . . . . 0.0 107.491 178.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -60.53 95.29 0.11 Allowed 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.287 1.992 . . . . 0.0 112.47 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.448 HG21 HD21 ' A' ' 35' ' ' LEU . 10.0 t -75.27 124.62 89.29 Favored Pre-proline 0 N--CA 1.424 -1.74 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.058 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.39 -29.36 13.85 Favored 'Trans proline' 0 C--O 1.245 0.869 0 C-N-CA 122.402 2.068 . . . . 0.0 111.752 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -141.54 151.72 61.39 Favored Pre-proline 0 CA--C 1.486 -1.496 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 -176.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.496 ' HA ' HD12 ' A' ' 35' ' ' LEU . 38.1 Cg_endo -71.67 -7.35 21.0 Favored 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 121.587 1.525 . . . . 0.0 111.611 175.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -87.9 -12.9 43.39 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-O 121.318 0.58 . . . . 0.0 110.69 177.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.53 -6.09 54.48 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 122.159 0.98 . . . . 0.0 108.722 175.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.566 ' O ' ' HG2' ' A' ' 40' ' ' MET . 27.6 mt -91.75 6.53 45.59 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.797 -179.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -133.07 21.91 4.12 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.619 ' OD1' ' HD3' ' A' ' 38' ' ' ARG . 13.9 t70 -85.16 170.26 13.06 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.695 -1.593 . . . . 0.0 108.449 -178.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.619 ' HD3' ' OD1' ' A' ' 37' ' ' ASP . 0.1 OUTLIER -71.63 -24.74 61.93 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.939 0.876 . . . . 0.0 110.567 178.747 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.618 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 40.3 ttp180 -75.02 -21.2 59.23 Favored 'General case' 0 N--CA 1.442 -0.857 0 CA-C-N 114.818 -1.083 . . . . 0.0 109.109 178.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.768 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 9.2 tpp -60.67 -34.26 74.05 Favored 'General case' 0 C--O 1.207 -1.155 0 CA-C-N 115.124 -0.943 . . . . 0.0 112.413 -179.189 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.36 -31.24 71.86 Favored 'General case' 0 C--O 1.197 -1.689 0 C-N-CA 117.748 -1.581 . . . . 0.0 110.711 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.45 HD22 HD23 ' A' ' 43' ' ' LEU . 5.5 t30 -74.31 -46.49 40.7 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 121.393 0.616 . . . . 0.0 109.712 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.3 mt -59.78 -49.63 76.97 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.578 -179.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.768 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.6 p -73.3 -27.68 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.371 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.577 -178.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.31 -47.06 86.83 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 177.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.538 ' HA ' ' HG2' ' A' ' 49' ' ' LYS . 16.6 t80 -62.91 -45.69 91.34 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.068 174.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.66 94.12 Favored 'General case' 0 C--O 1.203 -1.352 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.216 -177.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -62.85 -44.79 95.19 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 123.29 0.636 . . . . 0.0 111.327 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.538 ' HG2' ' HA ' ' A' ' 46' ' ' TYR . 53.9 pttt -66.64 -36.49 82.7 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.645 0.736 . . . . 0.0 110.702 -177.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.509 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 69.4 t -75.23 -42.68 44.18 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.668 178.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.77 -43.3 90.33 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 177.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.23 -43.44 98.46 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.502 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.406 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 21.3 t70 -53.93 -51.97 62.08 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.257 0.623 . . . . 0.0 111.373 178.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.474 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -74.28 -27.6 60.81 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 113.75 1.019 . . . . 0.0 113.75 179.66 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -63.86 -49.86 71.08 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 176.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -73.18 -22.63 60.44 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.979 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.3 t -81.37 -13.6 58.14 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.136 178.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -98.26 169.58 9.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.532 0.682 . . . . 0.0 112.487 -178.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -119.13 6.38 11.27 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.468 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.9 m -164.94 147.37 8.2 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.755 ' HB3' HG22 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -55.87 -40.39 72.87 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 175.343 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -56.17 -46.13 79.44 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.229 0.537 . . . . 0.0 110.139 178.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.65 -46.42 82.59 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 114.911 -1.04 . . . . 0.0 112.153 178.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -44.06 92.95 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 123.366 0.416 . . . . 0.0 109.994 -177.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -59.83 -47.58 85.15 Favored 'General case' 0 C--O 1.201 -1.45 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.631 175.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -62.31 -48.42 79.95 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -177.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.474 HD11 ' CB ' ' A' ' 54' ' ' MET . 3.9 pp -71.97 -30.69 65.53 Favored 'General case' 0 C--O 1.258 1.507 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.273 -175.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.71 HD21 HD23 ' A' ' 18' ' ' LEU . 1.1 pp -75.77 -33.6 60.2 Favored 'General case' 0 CA--C 1.507 -0.685 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.554 ' HB1' ' HA ' ' B' ' 149' ' ' LEU . . . -62.07 -40.12 94.72 Favored 'General case' 0 C--O 1.198 -1.607 0 CA-C-N 115.03 -0.986 . . . . 0.0 108.781 176.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -62.87 -46.46 87.76 Favored 'General case' 0 C--O 1.259 1.58 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.932 177.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -66.77 -40.82 88.35 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.168 179.646 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 7.8 tt -67.08 -44.76 87.93 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.228 -178.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -52.64 -49.5 65.03 Favored 'General case' 0 C--O 1.257 1.449 0 C-N-CA 125.869 1.668 . . . . 0.0 111.215 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -69.18 -33.26 73.1 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.442 -179.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.549 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.5 mp -66.28 -39.28 83.82 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 116.772 -0.194 . . . . 0.0 110.707 175.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.592 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 22.5 mm-40 -58.62 -48.54 80.66 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.306 0.575 . . . . 0.0 109.491 178.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.735 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS 0.252 0.0 OUTLIER -69.5 -33.35 72.72 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 175.917 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -59.37 -45.92 90.1 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 176.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.4 pp -67.36 -39.71 85.73 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.459 -179.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.581 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 14.6 pt-20 -63.74 -45.16 91.16 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.04 0.382 . . . . 0.0 110.457 -178.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.57 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.7 pt-20 -76.01 -37.8 58.02 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -33.34 72.92 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.034 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 28.9 tpt180 -73.61 -38.35 65.11 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.455 ' O ' ' HD2' ' A' ' 84' ' ' ARG . 6.9 tmm_? -72.31 -18.02 61.81 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.585 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 84' ' ' ARG . 70.2 m 92.75 116.9 0.02 OUTLIER 'General case' 0 C--N 1.349 0.546 0 C-N-CA 126.607 1.963 . . . . 0.0 109.288 -172.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -119.48 -11.75 9.44 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -174.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 C--N 1.302 -1.464 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.185 -177.595 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.045 0 N-CA-C 111.725 -0.55 . . . . 0.0 111.725 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 27.1 m -74.85 -33.39 62.12 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.662 0.268 . . . . 0.0 111.715 -178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 47.3 ttm -89.38 -27.42 20.46 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 43.4 t 76.27 134.4 0.06 Allowed 'General case' 0 C--O 1.24 0.595 0 C-N-CA 125.171 1.389 . . . . 0.0 109.992 -175.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 45.3 m80 -63.14 -41.22 99.25 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 47.5 t80 72.29 -12.96 0.66 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.571 1.548 . . . . 0.0 114.315 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -84.54 -75.16 1.22 Allowed Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.036 -1.078 . . . . 0.0 110.742 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -87.14 26.35 1.2 Allowed 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 123.5 0.72 . . . . 0.0 111.261 -177.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.13 -26.34 60.36 Favored 'General case' 0 C--O 1.213 -0.862 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 178.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 12.3 m -55.04 -45.9 75.26 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.434 1.094 . . . . 0.0 111.12 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.38 -57.12 12.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.091 -175.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -73.8 -36.55 65.01 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -174.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -70.14 -42.77 72.11 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 -178.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.566 HD21 ' HB3' ' A' ' 79' ' ' LEU . 48.8 tp -73.23 -24.69 60.52 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-O 120.765 0.317 . . . . 0.0 110.827 179.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.16 -42.34 66.02 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 175.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 30.7 m -68.83 -35.59 77.16 Favored 'General case' 0 CA--C 1.553 1.059 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.216 178.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . . . . . . . . . 29.8 m -74.48 -26.64 60.14 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-O 121.36 0.6 . . . . 0.0 110.876 177.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 15.1 t70 -68.0 -48.53 65.49 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.1 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 7.6 p -69.71 -28.09 65.53 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.309 178.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.18 -36.72 83.83 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.414 0.685 . . . . 0.0 109.828 175.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 22.1 m -76.92 -14.3 59.88 Favored 'General case' 0 C--O 1.25 1.11 0 CA-C-O 121.612 0.72 . . . . 0.0 110.323 177.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 38.2 m80 73.98 -11.82 0.93 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.449 1.9 . . . . 0.0 114.286 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 5.5 p -160.43 172.01 18.03 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -172.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.84 144.83 56.58 Favored 'General case' 0 C--O 1.248 1.001 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -132.62 -172.01 12.91 Favored Glycine 0 N--CA 1.427 -1.906 0 C-N-CA 118.939 -1.601 . . . . 0.0 114.553 -175.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 151.18 -137.47 6.06 Favored Glycine 0 N--CA 1.439 -1.115 0 N-CA-C 109.874 -1.29 . . . . 0.0 109.874 178.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 96.74 74.02 1.18 Allowed Glycine 0 N--CA 1.441 -1.021 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.394 177.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 17.8 m -64.63 107.62 1.46 Allowed 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.912 0.386 . . . . 0.0 110.52 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -123.95 159.85 18.55 Favored Glycine 0 N--CA 1.433 -1.547 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -135.2 55.84 0.72 Allowed Glycine 0 N--CA 1.44 -1.047 0 C-N-CA 120.664 -0.779 . . . . 0.0 113.045 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -76.73 116.32 4.61 Favored Glycine 0 C--O 1.247 0.959 0 N-CA-C 111.597 -0.601 . . . . 0.0 111.597 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . 0.522 ' HB3' ' OE1' ' B' ' 138' ' ' GLU . 14.8 m -136.23 -176.46 4.33 Favored 'General case' 0 C--O 1.254 1.314 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -178.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 172.5 9.02 0.02 OUTLIER Glycine 0 CA--C 1.536 1.388 0 C-N-CA 120.738 -0.744 . . . . 0.0 114.128 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -109.03 -96.53 2.44 Favored Glycine 0 N--CA 1.441 -0.98 0 O-C-N 122.051 -0.676 . . . . 0.0 111.916 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . 0.527 ' O ' ' HG2' ' B' ' 138' ' ' GLU . . . 169.89 -150.85 15.58 Favored Glycine 0 N--CA 1.44 -1.061 0 C-N-CA 121.039 -0.6 . . . . 0.0 111.885 -178.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 29.0 m 67.26 -81.3 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 124.358 1.063 . . . . 0.0 112.4 179.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' B' ' 141' ' ' MET . 65.0 mt -106.23 -50.07 3.23 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-O 120.978 0.418 . . . . 0.0 111.032 -175.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' B' ' 135' ' ' GLY . 10.9 pt-20 -47.88 -36.3 11.91 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.889 1.811 . . . . 0.0 115.889 -168.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 14.2 p -65.15 -36.64 84.89 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.182 0.515 . . . . 0.0 112.16 -177.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -120.43 27.36 8.63 Favored 'General case' 0 CA--C 1.499 -0.999 0 CA-C-O 121.432 0.634 . . . . 0.0 109.443 -175.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.559 ' HG2' ' HB ' ' B' ' 145' ' ' ILE . 53.4 ttp -97.4 -15.77 20.52 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.509 -0.769 . . . . 0.0 113.002 -172.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -46.51 -58.09 4.1 Favored 'General case' 0 CA--C 1.568 1.646 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 -171.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 10.0 m -65.43 -39.57 92.26 Favored 'General case' 0 C--O 1.264 1.861 0 CA-C-O 121.922 0.868 . . . . 0.0 110.387 -176.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 47.1 mm -67.45 -44.87 86.53 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.133 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.365 -179.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.559 ' HB ' ' HG2' ' B' ' 141' ' ' MET . 18.3 tt -67.82 -31.13 50.88 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-O 120.832 0.349 . . . . 0.0 111.494 -176.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.42 -65.31 0.71 Allowed 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.062 171.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.7 p -61.1 -43.11 99.38 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -174.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -81.32 -46.69 14.35 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -178.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.554 ' HA ' ' HB1' ' A' ' 69' ' ' ALA 0.279 8.2 tt -88.16 -36.39 16.86 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -169.138 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.74 124.47 6.01 Favored 'General case' 0 CA--C 1.484 -1.591 0 C-N-CA 117.045 -1.862 . . . . 0.0 113.437 179.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -100.82 94.61 6.14 Favored 'General case' 0 C--N 1.277 -2.545 0 CA-C-N 114.107 -1.406 . . . . 0.0 109.004 176.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.274 -2.697 0 N-CA-C 106.134 -1.802 . . . . 0.0 106.134 173.532 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.554 0 N-CA-C 111.129 -0.789 . . . . 0.0 111.129 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 26.9 m -71.14 169.6 1.46 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.037 0 CA-C-O 121.075 0.464 . . . . 0.0 111.081 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -92.26 96.37 10.25 Favored 'General case' 0 N--CA 1.41 -2.45 0 C-N-CA 119.115 -1.034 . . . . 0.0 112.748 -171.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.465 ' HD3' ' HE1' ' A' ' 6' ' ' TRP . 82.9 mttt -127.19 124.92 40.11 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 114.269 -1.332 . . . . 0.0 108.292 175.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -56.58 -22.38 39.01 Favored Glycine 0 N--CA 1.464 0.56 0 O-C-N 123.904 0.752 . . . . 0.0 114.892 -173.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.465 ' HE1' ' HD3' ' A' ' 4' ' ' LYS . 68.9 p-90 -74.97 -5.02 41.66 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 122.216 -0.579 . . . . 0.0 112.173 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -61.04 -26.59 67.73 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 117.98 0.354 . . . . 0.0 110.941 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -78.13 -7.05 56.52 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.595 0.712 . . . . 0.0 110.368 179.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 -102.35 3.14 37.65 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.817 -177.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.406 HG23 HD12 ' A' ' 14' ' ' LEU . 6.0 p -136.52 109.55 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.843 0 CA-C-O 122.157 0.98 . . . . 0.0 108.839 -179.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.5 m -86.37 155.76 20.47 Favored 'General case' 0 C--N 1.286 -2.162 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.376 -175.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.71 -39.47 51.61 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.409 1.084 . . . . 0.0 110.928 177.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -57.43 -41.11 79.8 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 178.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.542 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.1 tm? -69.02 -52.31 30.0 Favored 'General case' 0 CA--C 1.485 -1.543 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -175.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.574 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.8 ptm180 -64.5 -44.67 90.22 Favored 'General case' 0 N--CA 1.413 -2.299 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.985 -176.156 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.3 t -64.21 -29.93 71.01 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.946 0.403 . . . . 0.0 110.038 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 12.0 t60 -66.18 -45.57 80.39 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.736 HD23 HD21 ' A' ' 68' ' ' LEU . 4.9 mp -66.24 -39.42 89.52 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.739 177.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 15' ' ' ARG . 62.2 t -58.15 -50.18 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 124.329 1.052 . . . . 0.0 110.361 175.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -54.8 -46.56 74.51 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.483 177.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -65.94 -38.83 89.65 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.848 177.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.513 ' O ' HG22 ' A' ' 26' ' ' ILE . 20.7 mt -52.09 -49.31 63.84 Favored 'General case' 0 CA--C 1.498 -1.033 0 O-C-N 123.859 0.724 . . . . 0.0 110.023 174.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.458 HG13 ' HB3' ' A' ' 43' ' ' LEU . 71.2 t -56.62 -52.36 54.64 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.677 0 O-C-N 124.139 0.899 . . . . 0.0 109.825 175.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -53.58 -34.5 58.58 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -178.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB1' HG22 ' A' ' 75' ' ' ILE . . . -81.5 -45.9 15.3 Favored 'General case' 0 C--O 1.2 -1.539 0 CA-C-O 121.152 0.501 . . . . 0.0 111.917 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.533 HG13 ' CZ ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -75.31 -32.94 26.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-O 121.365 0.602 . . . . 0.0 110.679 -175.05 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.501 ' CD2' HG23 ' A' ' 26' ' ' ILE . 56.4 m-85 -128.56 91.57 43.22 Favored Pre-proline 0 C--N 1.283 -2.284 0 C-N-CA 124.801 1.24 . . . . 0.0 108.256 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.21 96.55 0.34 Allowed 'Trans proline' 0 N--CA 1.447 -1.224 0 C-N-CA 121.51 1.473 . . . . 0.0 110.062 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.8 t -52.64 123.56 31.1 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.879 -176.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.88 -16.88 29.28 Favored 'Trans proline' 0 C--O 1.237 0.451 0 C-N-CA 122.389 2.059 . . . . 0.0 112.27 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -163.39 148.54 9.26 Favored Pre-proline 0 N--CA 1.446 -0.638 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -174.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.43 ' O ' HD12 ' A' ' 35' ' ' LEU . 4.8 Cg_endo -52.57 -27.59 33.3 Favored 'Trans proline' 0 CA--C 1.559 1.749 0 C-N-CA 123.34 2.694 . . . . 0.0 113.172 173.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -83.63 -11.61 57.05 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 121.133 -0.98 . . . . 0.0 111.813 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.44 -42.1 30.93 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.085 0.469 . . . . 0.0 110.692 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.43 HD12 ' O ' ' A' ' 32' ' ' PRO 0.326 0.3 OUTLIER -75.84 8.51 3.02 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 178.039 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -133.06 17.97 4.11 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.408 0.623 . . . . 0.0 110.263 174.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.574 ' O ' ' HB3' ' A' ' 40' ' ' MET . 36.6 t70 -93.21 -178.38 4.75 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.721 -178.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.536 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -70.91 -22.45 62.25 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 121.916 -0.49 . . . . 0.0 110.46 179.246 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.571 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 42.3 ttm180 -73.27 -21.9 60.5 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.516 0.674 . . . . 0.0 109.716 176.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.657 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 5.4 tpp -61.55 -34.53 75.72 Favored 'General case' 0 C--O 1.197 -1.704 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.869 177.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.615 ' HA ' HG12 ' A' ' 44' ' ' VAL . 12.9 pt-20 -66.97 -24.86 66.1 Favored 'General case' 0 C--O 1.2 -1.531 0 C-N-CA 118.33 -1.348 . . . . 0.0 110.844 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.443 HD22 HD23 ' A' ' 43' ' ' LEU . 4.7 t30 -74.28 -44.58 52.18 Favored 'General case' 0 C--O 1.249 1.063 0 CA-C-O 121.485 0.659 . . . . 0.0 109.548 174.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 39' ' ' ARG . 22.4 mt -63.08 -49.12 75.75 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.504 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.657 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 2.6 p -70.58 -27.89 32.7 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.337 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.685 -178.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.31 96.28 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 176.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.572 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 5.1 t80 -60.79 -47.76 84.85 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 173.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.81 -43.41 94.53 Favored 'General case' 0 C--O 1.197 -1.709 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.999 -176.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -64.0 -42.39 97.17 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 123.525 0.73 . . . . 0.0 112.06 177.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 17.4 pttp -68.01 -37.09 81.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.489 0.661 . . . . 0.0 110.056 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.486 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 52.9 t -73.06 -49.41 38.93 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.576 178.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HG3' ' CG2' ' A' ' 19' ' ' VAL . 13.8 tm-20 -56.62 -46.07 81.16 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 124.112 0.965 . . . . 0.0 109.202 178.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.493 ' O ' ' HG2' ' A' ' 56' ' ' GLU . . . -58.01 -48.19 84.24 Favored Glycine 0 N--CA 1.432 -1.609 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.88 178.307 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -56.71 -51.16 69.87 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.118 0.485 . . . . 0.0 111.781 -179.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.512 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -67.99 -29.62 68.68 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 179.139 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.421 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 65.6 t80 -62.75 -51.52 66.83 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 176.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 52' ' ' GLY . 5.9 mm-40 -71.95 -24.48 61.62 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.691 -177.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 t -79.55 -22.05 44.33 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.312 0.577 . . . . 0.0 110.183 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -93.15 162.81 13.87 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 121.157 0.504 . . . . 0.0 111.171 -177.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -118.51 19.01 13.45 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.647 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 78.5 p -167.21 157.2 10.98 Favored 'General case' 0 CA--C 1.488 -1.441 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 171.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HA ' ' HD2' ' A' ' 64' ' ' TYR . 0.1 OUTLIER -72.29 -26.1 61.84 Favored 'General case' 0 C--N 1.308 -1.196 0 C-N-CA 119.241 -0.984 . . . . 0.0 111.432 179.135 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -65.53 -47.37 76.15 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.87 -47.31 86.27 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.865 177.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.416 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -65.19 -46.63 79.97 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.963 -176.892 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 2.4 t80 -60.99 -43.43 98.88 Favored 'General case' 0 C--O 1.203 -1.351 0 O-C-N 123.8 0.687 . . . . 0.0 110.301 178.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.436 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 31.8 t-80 -62.88 -54.66 35.24 Favored 'General case' 0 C--O 1.214 -0.789 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.1 pp -65.39 -33.64 76.43 Favored 'General case' 0 C--O 1.272 2.286 0 CA-C-O 121.413 0.625 . . . . 0.0 111.634 -175.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.736 HD21 HD23 ' A' ' 18' ' ' LEU . 0.9 OUTLIER -73.79 -35.29 64.9 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.236 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.556 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -63.78 -34.49 78.02 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.159 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 66' ' ' HIS . 17.4 mt-10 -68.44 -46.76 69.0 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 120.134 -0.626 . . . . 0.0 110.055 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -64.73 -36.83 85.55 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 119.501 -0.88 . . . . 0.0 111.512 -179.038 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.642 HD13 HD11 ' B' ' 149' ' ' LEU . 8.9 tt -69.31 -47.07 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.048 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.576 179.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.483 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 23.0 t80 -51.68 -49.94 61.4 Favored 'General case' 0 C--O 1.256 1.427 0 C-N-CA 125.889 1.676 . . . . 0.0 111.063 178.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -67.35 -34.64 77.74 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.679 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.557 HG22 ' HB1' ' A' ' 25' ' ' ALA . 1.3 mp -68.79 -34.83 66.68 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 CA-C-O 120.603 0.239 . . . . 0.0 111.086 177.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 72' ' ' ILE . 22.1 mm-40 -62.06 -49.52 75.67 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.505 ' NZ ' ' HB3' ' A' ' 77' ' ' LYS . 0.5 OUTLIER -71.92 -31.04 65.97 Favored 'General case' 0 C--N 1.311 -1.085 0 C-N-CA 119.656 -0.818 . . . . 0.0 113.088 177.491 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -57.92 -50.35 73.65 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 175.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.5 pp -64.93 -36.95 86.04 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.379 -179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 77' ' ' LYS . 3.2 mm-40 -61.01 -53.54 56.01 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.131 0.572 . . . . 0.0 111.612 177.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.0 pt-20 -69.5 -39.8 77.4 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.854 -177.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -65.61 -34.23 77.76 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -178.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -77.76 -40.89 39.42 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.904 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.9 tpp180 -71.84 -59.43 2.75 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-O 118.776 -0.63 . . . . 0.0 111.256 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 39.1 m 166.13 87.69 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 126.72 2.008 . . . . 0.0 109.757 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -97.14 -28.74 13.97 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 174.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 69.7 mt . . . . . 0 C--O 1.251 1.176 0 CA-C-N 113.859 -1.519 . . . . 0.0 109.02 177.533 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.593 0 N-CA-C 111.28 -0.728 . . . . 0.0 111.28 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 13.9 t -97.36 -36.78 10.27 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 92.9 mmm -85.84 -17.64 35.08 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.853 0.835 . . . . 0.0 110.159 177.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 16.7 t -95.11 109.91 21.92 Favored 'General case' 0 N--CA 1.411 -2.412 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 174.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -86.06 154.8 21.15 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 120.089 -0.644 . . . . 0.0 110.871 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . 0.407 ' HA ' ' OE1' ' B' ' 109' ' ' GLN . 51.9 p90 -171.94 160.83 5.56 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 106.141 -1.799 . . . . 0.0 106.141 -174.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 78.26 -59.43 3.99 Favored Glycine 0 C--N 1.308 -0.974 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 -178.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -74.66 27.88 0.09 Allowed 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 125.477 1.511 . . . . 0.0 112.902 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.636 HE21 ' HA ' ' B' ' 109' ' ' GLN . 0.0 OUTLIER -71.37 -36.31 71.4 Favored 'General case' 0 N--CA 1.424 -1.742 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.837 -175.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 3.8 p -71.1 -38.78 72.37 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.848 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 31.8 tp -57.17 -58.06 9.88 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.701 176.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -67.78 -37.3 81.88 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.779 -176.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -63.72 -52.6 59.79 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.49 HD21 ' HA ' ' A' ' 26' ' ' ILE . 0.2 OUTLIER -68.97 -30.32 68.71 Favored 'General case' 0 C--O 1.207 -1.151 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.603 -178.087 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.3 tp -65.37 -36.93 85.48 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 176.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 62.4 m -64.36 -46.39 83.6 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.408 ' O ' ' HB3' ' B' ' 120' ' ' LEU . 14.7 m -67.03 -34.69 78.25 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.974 178.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -64.91 -34.1 77.6 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 123.901 0.881 . . . . 0.0 108.85 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 38.9 m -71.93 -25.49 61.92 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.658 177.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' B' ' 117' ' ' SER . 8.0 tt -66.14 -45.66 80.25 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 16.7 m -64.52 -49.8 69.89 Favored 'General case' 0 C--O 1.25 1.13 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 174.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 18.2 t60 71.37 -62.0 0.47 Allowed 'General case' 0 C--N 1.341 0.203 0 C-N-CA 125.722 1.609 . . . . 0.0 112.054 175.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 36.3 p -96.13 76.46 3.06 Favored 'General case' 0 N--CA 1.417 -2.08 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.635 -176.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 44.7 t0 68.54 176.27 0.27 Allowed 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 124.434 1.094 . . . . 0.0 112.103 175.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -157.45 130.64 2.67 Favored Glycine 0 N--CA 1.435 -1.426 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -151.01 103.77 0.25 Allowed Glycine 0 N--CA 1.437 -1.238 0 C-N-CA 120.447 -0.883 . . . . 0.0 113.306 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -134.46 149.41 19.81 Favored Glycine 0 C--N 1.305 -1.165 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 44.8 m -141.0 173.22 11.69 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 117.904 0.852 . . . . 0.0 111.535 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -156.61 130.19 2.62 Favored Glycine 0 N--CA 1.435 -1.42 0 N-CA-C 109.126 -1.59 . . . . 0.0 109.126 176.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -108.1 -168.36 21.4 Favored Glycine 0 C--N 1.302 -1.35 0 C-N-CA 120.018 -1.087 . . . . 0.0 112.682 -176.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . -124.51 178.56 16.44 Favored Glycine 0 N--CA 1.434 -1.486 0 N-CA-C 110.229 -1.148 . . . . 0.0 110.229 178.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 23.0 t -178.48 -77.23 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -178.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -111.79 159.05 13.94 Favored Glycine 0 N--CA 1.432 -1.612 0 N-CA-C 109.219 -1.552 . . . . 0.0 109.219 174.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -162.27 99.68 0.17 Allowed Glycine 0 N--CA 1.425 -2.058 0 C-N-CA 119.911 -1.137 . . . . 0.0 112.685 -178.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -159.06 16.94 0.25 Allowed Glycine 0 C--N 1.305 -1.149 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 177.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.565 ' HB3' ' H ' ' B' ' 140' ' ' ASP . 22.8 t -167.34 165.8 14.89 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 -176.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.552 ' O ' ' HB3' ' B' ' 141' ' ' MET . 2.7 pt? -93.72 -47.21 6.89 Favored 'General case' 0 C--O 1.184 -2.349 0 C-N-CA 119.486 -0.886 . . . . 0.0 109.863 174.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.434 ' HB3' ' HB2' ' A' ' 14' ' ' LEU 0.277 19.5 pt-20 -85.64 -28.81 24.52 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 116.489 2.033 . . . . 0.0 116.489 -177.88 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 44.2 t -100.36 -61.36 1.38 Allowed 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 118.984 -1.086 . . . . 0.0 112.922 -174.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . 0.565 ' H ' ' HB3' ' B' ' 136' ' ' SER . 13.9 m-20 -115.91 82.83 1.83 Allowed 'General case' 0 CA--C 1.476 -1.898 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -178.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.552 ' HB3' ' O ' ' B' ' 137' ' ' LEU . 17.8 ptm -103.0 -37.21 7.88 Favored 'General case' 0 C--O 1.181 -2.544 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -167.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.483 ' CD ' ' H ' ' B' ' 142' ' ' GLU . 1.8 mp0 -26.92 -61.1 0.09 Allowed 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -167.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 28.5 m -71.27 -38.19 71.88 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.834 -0.541 . . . . 0.0 111.671 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 48.0 mm -68.68 -47.56 75.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.504 ' HA ' ' OH ' ' A' ' 65' ' ' TYR . 7.9 tp -61.75 -39.07 82.01 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.307 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 41.3 ttt180 -65.35 -49.5 69.11 Favored 'General case' 0 N--CA 1.443 -0.819 0 C-N-CA 118.573 -1.251 . . . . 0.0 110.82 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 28.9 m -66.08 -44.84 83.28 Favored 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -78.0 -40.28 39.57 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 121.076 -0.249 . . . . 0.0 111.586 -175.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.642 HD11 HD13 ' A' ' 72' ' ' ILE . 2.8 tm? -79.48 -50.73 10.31 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.358 -173.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.47 ' SD ' HD12 ' B' ' 149' ' ' LEU . 0.0 OUTLIER -149.4 83.49 1.42 Allowed 'General case' 0 C--O 1.244 0.768 0 C-N-CA 118.027 -1.469 . . . . 0.0 114.483 -178.406 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 76.39 149.77 0.11 Allowed 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 169.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.116 0 CA-C-N 114.393 -1.276 . . . . 0.0 108.293 177.063 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.568 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 31.0 m -94.58 134.46 31.97 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.486 ' HD2' ' H ' ' A' ' 3' ' ' ARG . 0.2 OUTLIER -102.82 110.37 22.27 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 121.724 0.773 . . . . 0.0 111.706 -177.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.615 ' HB2' ' CD1' ' A' ' 6' ' ' TRP . 12.2 ptpt -152.08 84.29 1.27 Allowed 'General case' 0 C--N 1.291 -1.976 0 CA-C-N 114.58 -1.191 . . . . 0.0 110.175 177.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.02 -8.4 8.33 Favored Glycine 0 C--O 1.243 0.669 0 CA-C-N 114.29 -1.323 . . . . 0.0 115.471 -173.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.615 ' CD1' ' HB2' ' A' ' 4' ' ' LYS . 59.7 p-90 -62.48 -16.25 54.4 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 117.129 0.465 . . . . 0.0 111.405 177.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -59.97 -11.84 6.6 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 178.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -89.82 -8.31 52.35 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.034 0.445 . . . . 0.0 110.336 178.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -107.6 13.61 26.51 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.628 0.728 . . . . 0.0 111.042 -174.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.3 p -134.14 110.52 13.86 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.205 0 CA-C-O 122.156 0.979 . . . . 0.0 108.598 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.9 m -81.16 154.35 26.76 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.197 -173.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.425 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -59.49 -34.84 73.08 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.415 178.458 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.98 -39.21 81.05 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.941 176.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.536 ' O ' HD13 ' A' ' 18' ' ' LEU . 2.9 tm? -69.67 -52.43 25.82 Favored 'General case' 0 CA--C 1.493 -1.247 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 -177.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.568 ' O ' HG23 ' A' ' 19' ' ' VAL . 6.2 ptm180 -65.1 -44.17 89.7 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.882 -175.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.0 t -66.52 -27.13 67.52 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 24.9 t60 -67.62 -46.31 72.87 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.705 HD23 HD21 ' A' ' 68' ' ' LEU . 5.1 mp -63.89 -38.99 93.13 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.698 177.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 15' ' ' ARG . 75.6 t -58.19 -48.38 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 123.644 0.778 . . . . 0.0 109.972 174.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.537 ' O ' ' HB ' ' A' ' 23' ' ' VAL . 18.5 t-80 -55.37 -45.85 76.5 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.445 0.698 . . . . 0.0 110.351 177.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.581 ' HD3' HD22 ' B' ' 149' ' ' LEU . 34.1 mttp -65.67 -38.65 89.87 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.87 178.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.99 -44.65 82.91 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.537 ' HB ' ' O ' ' A' ' 20' ' ' HIS . 25.1 t -53.73 -49.36 57.91 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.906 0 C-N-CA 124.055 0.942 . . . . 0.0 110.931 172.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -69.61 -25.86 64.16 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.029 -0.668 . . . . 0.0 112.58 -176.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.421 ' O ' HD11 ' B' ' 114' ' ' LEU . . . -78.83 -42.18 28.3 Favored 'General case' 0 C--O 1.196 -1.732 0 C-N-CA 120.971 -0.292 . . . . 0.0 110.747 174.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.496 ' HA ' HD21 ' B' ' 114' ' ' LEU . 3.9 tt -70.68 -38.82 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 119.902 -0.719 . . . . 0.0 111.194 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.421 ' HA ' ' HD2' ' A' ' 28' ' ' PRO . 84.4 t80 -125.52 99.09 33.61 Favored Pre-proline 0 N--CA 1.415 -2.192 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -175.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 27' ' ' PHE . 19.5 Cg_endo -60.43 97.84 0.12 Allowed 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 121.735 1.623 . . . . 0.0 108.815 170.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.0 t -75.8 136.68 70.24 Favored Pre-proline 0 N--CA 1.426 -1.664 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.624 -176.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.48 -21.3 11.68 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 122.498 2.132 . . . . 0.0 111.677 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -158.31 141.93 11.11 Favored Pre-proline 0 CA--C 1.496 -1.133 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -176.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -55.49 -20.04 25.16 Favored 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 122.913 2.409 . . . . 0.0 114.61 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.9 -10.04 59.41 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 121.171 -0.956 . . . . 0.0 112.03 179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -78.21 -6.56 55.24 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 122.179 0.99 . . . . 0.0 108.828 174.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.506 ' O ' ' HG2' ' A' ' 40' ' ' MET . 38.4 mt -90.94 5.65 47.85 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.22 -179.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -133.13 26.96 4.21 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 176.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.57 ' O ' ' HB3' ' A' ' 40' ' ' MET . 22.7 t70 -92.29 173.08 8.0 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.627 -1.169 . . . . 0.0 109.424 -177.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.544 ' HD3' ' OD2' ' A' ' 37' ' ' ASP . 0.2 OUTLIER -71.26 -25.94 62.68 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.209 0.528 . . . . 0.0 110.324 177.811 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.526 ' HD3' HD21 ' B' ' 120' ' ' LEU . 33.7 ttm180 -72.19 -27.43 62.55 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-O 121.589 0.709 . . . . 0.0 109.951 176.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.639 ' SD ' ' HB ' ' A' ' 44' ' ' VAL . 4.8 tpp -57.25 -37.41 72.26 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.242 178.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 11.6 pt-20 -61.44 -29.08 69.72 Favored 'General case' 0 C--O 1.202 -1.407 0 C-N-CA 119.023 -1.071 . . . . 0.0 110.245 -179.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.489 ' HB3' ' O ' ' A' ' 39' ' ' ARG . 4.3 t30 -69.68 -48.63 59.03 Favored 'General case' 0 C--O 1.253 1.25 0 C-N-CA 122.849 0.46 . . . . 0.0 109.993 175.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.446 HD22 ' O ' ' A' ' 39' ' ' ARG . 2.7 mm? -61.97 -51.61 67.37 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.274 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.639 ' HB ' ' SD ' ' A' ' 40' ' ' MET . 3.2 p -67.77 -29.21 44.3 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.832 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.082 -176.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.96 92.27 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.097 0.475 . . . . 0.0 109.865 176.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.57 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 1.7 t80 -62.38 -46.86 86.72 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.622 174.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.81 91.54 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.092 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -64.75 -44.28 90.59 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 123.742 0.817 . . . . 0.0 112.487 177.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.7 pttp -64.77 -39.94 94.44 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-O 121.489 0.661 . . . . 0.0 109.532 -178.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.1 t -67.68 -53.24 32.84 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.19 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.978 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -55.4 -48.33 74.52 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 124.036 0.934 . . . . 0.0 110.02 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.37 -37.79 94.65 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.099 -0.5 . . . . 0.0 112.486 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -64.52 -47.76 77.64 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-O 121.398 0.618 . . . . 0.0 110.718 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.471 ' CB ' HD11 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -70.28 -29.49 66.27 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 121.817 -0.552 . . . . 0.0 112.11 176.688 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -62.9 -54.7 34.54 Favored 'General case' 0 C--O 1.193 -1.873 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -68.99 -27.2 65.48 Favored 'General case' 0 C--N 1.307 -1.252 0 O-C-N 122.027 -0.421 . . . . 0.0 111.563 -177.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.2 t -74.34 -32.97 62.99 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 123.504 0.721 . . . . 0.0 112.455 -178.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.03 159.92 30.33 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -174.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -98.93 -1.98 38.65 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.171 178.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.434 ' HA ' ' CG ' ' A' ' 6' ' ' TRP . 66.4 p -168.17 158.0 9.84 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.529 174.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.486 ' HD3' ' H ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -62.56 -35.62 80.05 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -179.318 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -67.57 -33.67 75.5 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -70.75 -44.76 66.09 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.683 175.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -45.8 89.14 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.481 ' OH ' ' HA ' ' B' ' 145' ' ' ILE . 1.3 t80 -60.74 -46.59 89.83 Favored 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.031 176.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -59.18 -52.04 67.42 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.471 HD11 ' CB ' ' A' ' 54' ' ' MET . 4.4 pp -67.88 -37.63 82.02 Favored 'General case' 0 C--O 1.267 2.016 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.944 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.705 HD21 HD23 ' A' ' 18' ' ' LEU . 1.5 pp -68.9 -36.62 78.26 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.529 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -64.02 -41.21 97.52 Favored 'General case' 0 C--O 1.205 -1.263 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.607 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -62.77 -46.42 88.11 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.542 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -38.07 69.94 Favored 'General case' 0 N--CA 1.438 -1.047 0 C-N-CA 118.935 -1.106 . . . . 0.0 112.14 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.541 ' O ' ' HG2' ' A' ' 76' ' ' GLN . 4.2 tt -65.26 -45.83 92.46 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.15 178.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.489 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 17.8 t80 -53.29 -53.34 52.37 Favored 'General case' 0 C--O 1.272 2.259 0 C-N-CA 125.37 1.468 . . . . 0.0 111.409 178.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 18.3 ptpt -63.72 -34.22 77.39 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.756 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.78 -40.78 84.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 O-C-N 123.5 0.5 . . . . 0.0 111.913 177.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.601 ' O ' ' HG ' ' A' ' 79' ' ' LEU . 21.4 mm-40 -57.96 -53.59 56.57 Favored 'General case' 0 C--O 1.253 1.239 0 CA-C-O 121.967 0.889 . . . . 0.0 109.554 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.545 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 12.2 ptpt -70.3 -32.53 70.35 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 118.977 -1.089 . . . . 0.0 112.888 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.491 ' HB2' ' O ' ' A' ' 74' ' ' LYS . 18.6 tp10 -62.34 -46.35 89.07 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 76' ' ' GLN . 4.2 pp -63.45 -43.27 97.86 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.042 -177.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.495 ' N ' HD12 ' A' ' 79' ' ' LEU . 7.2 pt-20 -69.38 -43.82 72.74 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 118.809 -1.156 . . . . 0.0 112.156 -178.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 13.3 pt-20 -69.98 -32.27 70.4 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 120.325 -0.55 . . . . 0.0 112.066 -178.008 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.676 ' HA ' ' HG2' ' A' ' 86' ' ' ARG . 0.3 OUTLIER -72.93 -35.5 67.02 Favored 'General case' 0 C--O 1.215 -0.761 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.221 177.647 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.416 ' HD3' ' OD2' ' B' ' 118' ' ' ASP . 18.5 tpt180 -71.23 -31.54 67.69 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.149 -179.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -101.7 -54.39 2.75 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 -173.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 30.7 p -120.54 -30.22 4.57 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 118.491 2.775 . . . . 0.0 118.491 -167.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.676 ' HG2' ' HA ' ' A' ' 82' ' ' LYS . 3.1 ptp180 -88.15 -23.05 23.74 Favored 'General case' 0 C--N 1.27 -2.866 0 C-N-CA 117.976 -1.49 . . . . 0.0 111.482 -175.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 57.1 mt . . . . . 0 C--O 1.248 0.978 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 178.49 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.885 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 23.3 m -86.27 87.22 7.39 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 83.6 mmm -93.78 -26.99 16.73 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.78 -177.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . 0.482 ' HA ' ' NE2' ' B' ' 112' ' ' GLN . 22.9 t -90.73 -167.92 1.95 Allowed 'General case' 0 N--CA 1.426 -1.672 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.696 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . 0.496 ' O ' ' HB3' ' B' ' 109' ' ' GLN . 51.2 m-70 -133.95 172.01 13.39 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 107.175 -1.417 . . . . 0.0 107.175 -176.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -111.84 112.88 24.87 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 173.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 103.45 -71.83 0.28 Allowed Glycine 0 N--CA 1.429 -1.832 0 N-CA-C 110.78 -0.928 . . . . 0.0 110.78 -175.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -82.9 20.35 1.2 Allowed 'General case' 0 N--CA 1.478 0.929 0 CA-C-O 121.418 0.628 . . . . 0.0 111.547 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.496 ' HB3' ' O ' ' B' ' 105' ' ' HIS . 2.5 pp0? -62.82 -18.52 62.94 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.39 0.615 . . . . 0.0 110.262 173.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . 0.571 ' O ' ' HB2' ' B' ' 114' ' ' LEU . 1.0 OUTLIER -60.03 -24.64 64.68 Favored 'General case' 0 N--CA 1.411 -2.415 0 C-N-CA 125.428 1.491 . . . . 0.0 112.25 179.3 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.23 -58.57 8.04 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.243 0.544 . . . . 0.0 110.324 176.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . 0.482 ' NE2' ' HA ' ' B' ' 104' ' ' SER . 10.2 pt20 -76.04 -28.78 57.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.665 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . 0.537 ' HB3' ' HA ' ' B' ' 110' ' ' THR . 26.0 t70 -65.59 -45.26 83.89 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.88 176.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.571 ' HB2' ' O ' ' B' ' 110' ' ' THR . 0.1 OUTLIER -69.61 -31.59 69.81 Favored 'General case' 0 C--O 1.191 -2.007 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.524 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 58.9 tp -62.37 -33.35 74.57 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 121.211 0.529 . . . . 0.0 110.135 175.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 40.9 m -72.15 -43.69 64.25 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.477 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.509 ' O ' ' HB3' ' B' ' 120' ' ' LEU . 13.5 p -73.52 -26.89 61.08 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-O 121.442 0.639 . . . . 0.0 110.909 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.416 ' OD2' ' HD3' ' A' ' 83' ' ' ARG . 5.4 t70 -62.34 -42.85 99.73 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 124.456 1.102 . . . . 0.0 109.695 173.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 20.6 t -67.98 -33.49 74.74 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.277 178.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.526 HD21 ' HD3' ' A' ' 39' ' ' ARG . 4.2 tt -62.65 -51.16 68.34 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 46.2 m -60.96 -53.22 59.88 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.559 177.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 60.08 29.93 19.45 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.549 1.139 . . . . 0.0 109.844 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 4.6 p -148.37 170.72 17.34 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.263 -176.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -90.65 135.79 33.48 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 122.358 0.263 . . . . 0.0 110.814 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -167.71 175.11 42.72 Favored Glycine 0 N--CA 1.432 -1.616 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -179.18 37.74 0.08 OUTLIER Glycine 0 C--N 1.307 -1.031 0 N-CA-C 111.124 -0.79 . . . . 0.0 111.124 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . 78.24 -177.02 53.82 Favored Glycine 0 N--CA 1.438 -1.199 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.959 178.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 36.9 m -147.99 134.41 19.64 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . 155.61 146.44 4.44 Favored Glycine 0 N--CA 1.432 -1.621 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -105.79 -127.32 5.88 Favored Glycine 0 N--CA 1.435 -1.415 0 N-CA-C 110.173 -1.171 . . . . 0.0 110.173 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . 0.479 ' HA2' ' HB3' ' B' ' 142' ' ' GLU . . . 162.68 88.15 0.07 OUTLIER Glycine 0 N--CA 1.427 -1.928 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.112 177.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 4.9 p -91.69 -45.61 8.36 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 113.523 0.934 . . . . 0.0 113.523 178.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . 0.534 ' O ' ' HB2' ' B' ' 142' ' ' GLU . . . -158.69 146.29 12.91 Favored Glycine 0 C--O 1.226 -0.372 0 C-N-CA 119.003 -1.57 . . . . 0.0 113.378 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . -156.46 147.41 15.87 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 110.481 -1.047 . . . . 0.0 110.481 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -148.71 11.26 1.1 Allowed Glycine 0 C--O 1.241 0.586 0 N-CA-C 112.147 -0.381 . . . . 0.0 112.147 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.6 t -163.88 -167.19 1.31 Allowed 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.416 -1.698 . . . . 0.0 106.416 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.611 ' O ' ' HB3' ' B' ' 141' ' ' MET . 2.3 pt? -105.31 -49.54 3.43 Favored 'General case' 0 C--O 1.191 -2.003 0 C-N-CA 120.517 -0.473 . . . . 0.0 111.32 178.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.491 ' HA ' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -83.46 -44.8 14.35 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 115.543 1.683 . . . . 0.0 115.543 -171.917 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 28.3 t -87.28 -54.25 4.4 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.738 -176.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -129.39 95.77 4.11 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 -177.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.611 ' HB3' ' O ' ' B' ' 137' ' ' LEU . 21.5 ptp -102.36 -39.3 7.24 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 117.027 2.232 . . . . 0.0 117.027 -168.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.534 ' HB2' ' O ' ' B' ' 133' ' ' GLY . 47.1 mt-10 -21.92 -64.77 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 118.717 2.858 . . . . 0.0 118.717 -165.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 19.4 p -67.65 -44.69 77.3 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.172 0.511 . . . . 0.0 111.721 -171.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 57.2 mt -66.55 -46.6 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.946 -178.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . 0.485 ' O ' ' HB3' ' B' ' 149' ' ' LEU . 18.2 tt -67.65 -33.36 61.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -69.64 -52.45 25.77 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.642 176.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 16.3 m -64.85 -41.81 95.39 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -176.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -81.08 -39.89 24.99 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -177.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.581 HD22 ' HD3' ' A' ' 21' ' ' LYS . 8.3 tt -98.46 -30.24 12.65 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 -169.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 25.7 ptm -166.17 119.18 1.08 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -176.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -93.15 120.84 33.89 Favored 'General case' 0 CA--C 1.489 -1.394 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 166.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.294 -1.837 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 -177.84 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.491 -1.459 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.6 m -92.88 143.07 12.19 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 175.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.0 60.67 6.39 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-O 122.039 0.923 . . . . 0.0 112.299 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.458 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . 79.3 mttt -138.97 114.12 9.49 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.008 -179.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.31 -20.55 10.43 Favored Glycine 0 N--CA 1.466 0.648 0 N-CA-C 115.69 1.036 . . . . 0.0 115.69 -174.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.458 ' CD1' ' HB3' ' A' ' 4' ' ' LYS . 67.2 p-90 -70.39 -12.57 61.67 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 122.287 -0.537 . . . . 0.0 111.986 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -58.96 -21.2 58.05 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-O 120.92 0.391 . . . . 0.0 111.955 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -82.38 -13.48 56.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.477 0.656 . . . . 0.0 110.316 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -94.24 2.26 55.91 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.218 -176.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.457 ' HB ' ' HB3' ' A' ' 61' ' ' ARG . 6.9 p -129.12 110.86 21.44 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.67 0 CA-C-O 121.416 0.627 . . . . 0.0 110.07 -177.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.6 m -88.72 157.19 18.6 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.928 -176.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.59 -37.32 62.85 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.841 0.856 . . . . 0.0 111.267 178.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -63.07 -35.36 80.01 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.569 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.2 tm? -70.49 -52.0 25.03 Favored 'General case' 0 CA--C 1.488 -1.438 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 -176.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.509 ' O ' HG23 ' A' ' 19' ' ' VAL . 3.7 ptm180 -63.32 -44.62 94.43 Favored 'General case' 0 N--CA 1.42 -1.96 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.996 -178.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 t -61.95 -31.49 71.84 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.785 0.326 . . . . 0.0 110.445 178.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -66.66 -45.47 78.84 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.822 HD23 HD21 ' A' ' 68' ' ' LEU . 7.0 mp -67.32 -40.84 86.01 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.221 178.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 15' ' ' ARG . 54.6 t -56.47 -49.96 74.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 124.306 1.043 . . . . 0.0 109.828 175.012 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -58.12 -44.12 87.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.095 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.0 mttp -66.6 -40.92 89.1 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.931 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.524 ' O ' HG22 ' A' ' 26' ' ' ILE . 11.7 mt -50.83 -51.12 54.19 Favored 'General case' 0 CA--C 1.5 -0.959 0 O-C-N 124.211 0.944 . . . . 0.0 109.057 173.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.466 HG11 ' CE ' ' A' ' 40' ' ' MET . 79.2 t -55.23 -52.89 40.66 Favored 'Isoleucine or valine' 0 C--O 1.176 -2.799 0 O-C-N 124.484 1.115 . . . . 0.0 111.05 175.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -52.46 -35.83 53.38 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -177.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB2' HE21 ' A' ' 76' ' ' GLN . . . -81.89 -46.48 14.03 Favored 'General case' 0 C--O 1.2 -1.518 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 176.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.625 HG23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -77.5 -24.76 14.71 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-O 122.218 1.009 . . . . 0.0 110.499 -174.111 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.625 ' CD2' HG23 ' A' ' 26' ' ' ILE . 75.1 m-85 -131.01 86.52 51.53 Favored Pre-proline 0 C--N 1.271 -2.828 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.497 178.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -61.22 104.88 0.31 Allowed 'Trans proline' 0 N--CA 1.441 -1.57 0 N-CA-C 108.636 -1.332 . . . . 0.0 108.636 175.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.9 t -72.68 143.03 84.29 Favored Pre-proline 0 N--CA 1.422 -1.865 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.751 -173.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -77.94 -29.51 4.25 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.226 2.618 . . . . 0.0 111.073 175.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -137.72 135.92 19.54 Favored Pre-proline 0 CA--C 1.493 -1.215 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 -176.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -63.8 -18.42 63.92 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 121.472 1.448 . . . . 0.0 111.587 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -81.7 -15.25 55.04 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 121.748 -0.595 . . . . 0.0 111.189 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.76 -16.21 63.27 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 121.468 0.652 . . . . 0.0 109.353 175.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.5 mt -81.02 3.4 23.21 Favored 'General case' 0 C--O 1.214 -0.809 0 CA-C-N 114.496 -1.229 . . . . 0.0 110.547 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.81 10.85 2.89 Favored 'General case' 0 C--N 1.288 -2.095 0 O-C-N 121.366 -0.834 . . . . 0.0 110.099 170.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 40' ' ' MET . 1.9 t70 -104.72 -167.3 1.33 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.202 -170.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 0.0 OUTLIER -61.92 -36.39 81.23 Favored 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 118.264 0.484 . . . . 0.0 111.632 -177.093 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.554 ' O ' HD13 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -64.55 -33.82 76.8 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -177.864 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.569 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -59.77 -33.45 71.7 Favored 'General case' 0 C--O 1.171 -3.074 0 CA-C-O 118.435 -0.793 . . . . 0.0 111.1 -178.899 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 8.1 pt-20 -64.05 -34.18 77.43 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.235 0.925 . . . . 0.0 110.477 -176.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -71.81 -45.62 60.92 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.819 0.818 . . . . 0.0 109.379 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.562 HD22 ' HA ' ' A' ' 40' ' ' MET . 0.3 OUTLIER -57.01 -52.61 64.59 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 113.946 -1.479 . . . . 0.0 110.808 -179.147 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 40' ' ' MET . 27.6 m -69.97 -32.02 50.0 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.487 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.347 -179.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.64 -48.86 74.28 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 175.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.584 ' O ' ' HG2' ' A' ' 49' ' ' LYS . 9.7 t80 -63.92 -48.66 75.69 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.943 174.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.419 ' CB ' HG13 ' A' ' 19' ' ' VAL . . . -61.03 -40.66 94.43 Favored 'General case' 0 C--O 1.196 -1.752 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.498 -176.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 56.5 mttm -66.09 -42.28 89.54 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 123.676 0.79 . . . . 0.0 111.533 178.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 18.0 pttp -65.47 -40.65 93.4 Favored 'General case' 0 C--O 1.254 1.309 0 CA-C-O 121.443 0.639 . . . . 0.0 110.19 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.424 HG21 ' CZ ' ' A' ' 46' ' ' TYR . 78.3 t -71.56 -47.5 57.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.519 178.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -57.93 -47.68 82.15 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 123.53 0.732 . . . . 0.0 109.269 179.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.31 -39.46 92.65 Favored Glycine 0 CA--C 1.505 -0.551 0 O-C-N 123.673 0.608 . . . . 0.0 112.104 178.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.0 -54.26 48.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.034 0.445 . . . . 0.0 110.804 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.518 ' HB2' HD11 ' A' ' 67' ' ' LEU . 0.3 OUTLIER -67.89 -29.3 68.37 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 179.019 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -61.63 -54.39 43.54 Favored 'General case' 0 C--O 1.2 -1.526 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 176.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -74.02 -22.12 59.7 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.826 -0.546 . . . . 0.0 111.815 -176.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -79.96 -21.5 43.7 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-O 120.715 0.293 . . . . 0.0 111.01 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.05 165.14 17.76 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -176.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -107.08 -0.74 22.68 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.306 177.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.9 p -162.86 159.08 23.42 Favored 'General case' 0 CA--C 1.482 -1.648 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.457 ' HB3' ' HB ' ' A' ' 10' ' ' VAL . 0.1 OUTLIER -72.28 -24.73 61.39 Favored 'General case' 0 N--CA 1.438 -1.063 0 C-N-CA 119.016 -1.074 . . . . 0.0 110.344 178.531 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -63.62 -47.31 81.9 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -63.23 -47.98 80.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.785 176.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.414 ' HD2' ' HA ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -61.85 -45.7 92.66 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 123.156 0.285 . . . . 0.0 110.753 -176.977 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -62.2 -47.01 86.34 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.961 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.547 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 14.6 t60 -57.78 -54.59 45.12 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.408 0.443 . . . . 0.0 111.195 -178.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.518 HD11 ' HB2' ' A' ' 54' ' ' MET . 4.5 pp -67.71 -32.11 72.52 Favored 'General case' 0 C--O 1.245 0.833 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -175.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.822 HD21 HD23 ' A' ' 18' ' ' LEU . 1.2 pp -75.65 -31.0 59.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 179.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.554 ' HA ' HG22 ' A' ' 72' ' ' ILE . . . -67.23 -34.22 77.0 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.948 176.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 66' ' ' HIS . 10.6 mm-40 -66.8 -44.34 81.48 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.631 0.729 . . . . 0.0 109.318 176.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -42.59 86.45 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.096 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.554 HG22 ' HA ' ' A' ' 69' ' ' ALA . 6.0 tt -65.12 -46.61 90.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 C-N-CA 119.999 -0.681 . . . . 0.0 110.67 -178.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.698 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 59.4 t80 -50.65 -54.23 24.59 Favored 'General case' 0 C--O 1.268 2.043 0 C-N-CA 125.808 1.643 . . . . 0.0 110.764 177.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -63.74 -31.66 72.9 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.705 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -68.76 -37.57 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.475 177.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.572 ' OE1' ' HB2' ' B' ' 150' ' ' MET . 31.4 mt-30 -68.04 -42.04 81.16 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.832 -177.229 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.698 ' HE3' ' CE1' ' A' ' 73' ' ' TYR . 0.4 OUTLIER -70.24 -30.4 67.46 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 119.199 -1.001 . . . . 0.0 112.205 176.27 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.82 -45.42 89.7 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 176.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.601 ' HB3' HD21 ' B' ' 114' ' ' LEU . 4.6 pp -65.95 -41.2 91.59 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.536 ' HG2' ' HA ' ' A' ' 77' ' ' LYS . 16.0 pt-20 -69.86 -41.61 74.62 Favored 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.593 -177.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 8.4 pt-20 -65.79 -44.41 85.83 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.308 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.42 ' O ' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -65.18 -42.37 93.72 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.158 -175.952 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.415 ' HB2' ' HE2' ' A' ' 82' ' ' LYS . 54.4 ttp180 -77.69 -26.71 50.43 Favored 'General case' 0 C--O 1.243 0.755 0 C-N-CA 120.93 -0.308 . . . . 0.0 110.89 -178.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -71.57 -59.55 2.7 Favored 'General case' 0 C--O 1.245 0.848 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.951 -176.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.3 m -157.06 30.85 0.3 Allowed 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -171.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.42 ' HG2' ' O ' ' A' ' 82' ' ' LYS . 10.1 ptm180 -77.48 -19.25 56.2 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 116.895 -1.922 . . . . 0.0 109.49 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.7 mm? . . . . . 0 C--O 1.243 0.749 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.583 177.936 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.013 0 N-CA-C 110.738 -0.945 . . . . 0.0 110.738 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 26.4 m -85.14 86.97 7.34 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . 21.7 mmt -93.93 1.69 56.27 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.162 -178.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . 0.52 ' HA ' ' CD ' ' B' ' 109' ' ' GLN . 7.6 t 66.19 23.94 10.84 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.293 1.437 . . . . 0.0 110.792 176.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -82.1 -20.34 38.32 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.281 0.562 . . . . 0.0 110.43 -178.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -76.66 -48.86 17.69 Favored 'General case' 0 CA--C 1.502 -0.869 0 CA-C-O 121.519 0.676 . . . . 0.0 112.349 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.61 -45.07 1.36 Allowed Glycine 0 C--N 1.273 -2.935 0 N-CA-C 108.852 -1.699 . . . . 0.0 108.852 -175.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -107.84 17.57 22.34 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.136 -0.532 . . . . 0.0 110.244 179.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' GLN . . . . . 0.52 ' CD ' ' HA ' ' B' ' 104' ' ' SER . 5.2 pm0 -57.06 -32.36 66.14 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.645 177.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 2.2 t -55.4 -48.73 73.91 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 123.662 0.601 . . . . 0.0 111.221 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . 58.5 tp -66.84 -39.75 87.72 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.309 -176.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -70.71 -45.87 64.15 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 120.798 0.332 . . . . 0.0 111.202 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -61.37 -43.51 98.74 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.655 0.74 . . . . 0.0 109.039 176.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 114' ' ' LEU . . . . . 0.601 HD21 ' HB3' ' A' ' 79' ' ' LEU . 40.6 tp -68.98 -32.31 71.78 Favored 'General case' 0 C--O 1.188 -2.175 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.4 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 56.4 tp -69.9 -45.41 67.69 Favored 'General case' 0 C--O 1.246 0.907 0 O-C-N 121.88 -0.513 . . . . 0.0 110.412 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 35.7 m -61.56 -33.2 73.44 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.01 177.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 117' ' ' SER . . . . . 0.649 ' O ' ' HG ' ' B' ' 120' ' ' LEU . 19.8 m -77.67 -43.49 31.07 Favored 'General case' 0 CA--C 1.56 1.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.808 176.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' B' ' 114' ' ' LEU . 6.7 t70 -62.06 -34.26 75.94 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.799 1.24 . . . . 0.0 111.339 -175.06 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 119' ' ' SER . . . . . . . . . . . . . 2.6 p -62.12 -12.23 18.42 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -176.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' B' ' 117' ' ' SER . 2.3 pp -87.18 -10.11 53.48 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.266 176.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 121' ' ' SER . . . . . . . . . . . . . 27.8 t -76.43 -57.63 3.75 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.593 -176.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 70.71 -53.68 0.66 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.668 1.187 . . . . 0.0 109.37 -171.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 38.0 m -150.32 123.15 8.68 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 175.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 124' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -92.78 -165.51 1.35 Allowed 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -153.14 179.03 29.87 Favored Glycine 0 N--CA 1.422 -2.253 0 C-N-CA 120.075 -1.06 . . . . 0.0 112.393 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 135.48 -160.9 24.62 Favored Glycine 0 N--CA 1.425 -2.036 0 N-CA-C 111.777 -0.529 . . . . 0.0 111.777 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 127' ' ' GLY . . . . . . . . . . . . . . . -175.63 -178.41 45.43 Favored Glycine 0 C--N 1.299 -1.486 0 N-CA-C 107.379 -2.288 . . . . 0.0 107.379 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' SER . . . . . . . . . . . . . 9.9 t -126.32 174.86 8.26 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 118.605 1.202 . . . . 0.0 109.724 -177.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' GLY . . . . . . . . . . . . . . . -166.94 168.53 40.36 Favored Glycine 0 N--CA 1.434 -1.444 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -178.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 130' ' ' GLY . . . . . . . . . . . . . . . -86.08 -30.34 23.18 Favored Glycine 0 CA--C 1.502 -0.747 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 178.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 101.78 114.64 3.85 Favored Glycine 0 N--CA 1.428 -1.865 0 C-N-CA 121.02 -0.609 . . . . 0.0 112.467 177.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 132' ' ' SER . . . . . . . . . . . . . 8.8 m -109.26 95.66 5.78 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . 153.16 -108.92 0.39 Allowed Glycine 0 N--CA 1.437 -1.269 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.13 76.22 0.48 Allowed Glycine 0 C--N 1.316 -0.541 0 O-C-N 123.678 0.281 . . . . 0.0 112.583 178.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -167.68 110.35 0.39 Allowed Glycine 0 CA--C 1.492 -1.368 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 69.7 m 66.15 121.8 0.02 OUTLIER 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.312 1.045 . . . . 0.0 111.309 -175.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.514 HD23 ' H ' ' B' ' 137' ' ' LEU . 1.8 pt? -51.82 -46.4 64.29 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -174.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 138' ' ' GLU . . . . . 0.405 ' H ' ' CD ' ' B' ' 138' ' ' GLU . 0.1 OUTLIER -83.07 -12.72 56.88 Favored 'General case' 0 C--N 1.288 -2.087 0 O-C-N 121.308 -0.87 . . . . 0.0 112.241 -177.431 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 139' ' ' CYS . . . . . . . . . . . . . 81.1 m -86.49 -59.46 2.27 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.441 178.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 140' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -162.08 113.73 1.67 Allowed 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 121.155 0.502 . . . . 0.0 111.285 178.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 141' ' ' MET . . . . . 0.407 ' HG3' ' O ' ' B' ' 137' ' ' LEU . 58.0 mtm -102.92 -9.49 19.82 Favored 'General case' 0 C--O 1.188 -2.152 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.834 178.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -25.07 -60.25 0.06 Allowed 'General case' 0 N--CA 1.51 2.559 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 -168.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 143' ' ' SER . . . . . . . . . . . . . 5.2 p -61.27 -43.57 98.66 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 122.238 1.018 . . . . 0.0 111.128 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 144' ' ' ILE . . . . . . . . . . . . . 45.9 mm -70.2 -38.33 74.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.837 0 CA-C-N 114.005 -1.452 . . . . 0.0 109.73 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 145' ' ' ILE . . . . . . . . . . . . . 18.3 mm -54.7 -49.65 66.41 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.923 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.553 175.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -58.69 -65.11 0.71 Allowed 'General case' 0 N--CA 1.43 -1.442 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.308 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 65.3 m -61.97 -54.79 36.87 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 -174.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -81.47 -35.59 30.34 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -174.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 9.1 tt -96.63 -34.09 11.53 Favored 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -170.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 150' ' ' MET . . . . . 0.572 ' HB2' ' OE1' ' A' ' 76' ' ' GLN . 23.1 ptt? -160.24 52.04 0.31 Allowed 'General case' 0 C--O 1.246 0.913 0 C-N-CA 117.408 -1.717 . . . . 0.0 115.247 -176.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 151' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 83.77 110.73 0.06 Allowed 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 116.575 2.065 . . . . 0.0 116.575 167.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.002 0 C-N-CA 125.847 1.659 . . . . 0.0 107.77 173.158 . . . . . . . . 0 0 . 1 stop_ save_