data_5jpx_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 5jpx _Structure_validation_residue.Date_analyzed 2017-08-04 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 ' 90' ' ' GLU . . . . . 0.427 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 38.9 mt-10 . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -87.99 155.82 19.63 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.925 0.89 . . . . 0.0 110.224 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.55 100.63 3.94 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 170.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.49 -28.23 66.83 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.934 0.894 . . . . 0.0 112.371 -170.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 86.0 t -59.26 -43.37 89.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 123.565 0.746 . . . . 0.0 111.515 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -98.01 -37.81 9.62 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 121.125 0.488 . . . . 0.0 110.443 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.56 49.45 2.75 Favored Glycine 0 C--N 1.343 0.921 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.265 -174.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -138.48 161.64 36.51 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.338 0.655 . . . . 0.0 110.651 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -68.04 137.42 55.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.067 0.947 . . . . 0.0 109.159 170.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 3.3 pp -111.33 138.34 47.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.629 0.372 . . . . 0.0 110.991 -176.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.468 ' HA ' HD12 ' A' ' 128' ' ' LEU . 76.8 m-70 -141.11 96.61 3.03 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.586 0.754 . . . . 0.0 109.169 167.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.649 ' HA ' ' HA ' ' A' ' 127' ' ' PRO . 3.1 tm? -170.28 141.39 2.03 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 170.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -125.9 111.51 14.89 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 174.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . 0.482 ' SG ' ' SD ' ' A' ' 125' ' ' MET . 75.0 m -73.72 112.31 9.7 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 168.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -74.13 -37.7 64.01 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 13.5 ptmm? -63.08 -46.98 84.85 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.859 177.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.534 ' HB3' ' HD3' ' A' ' 108' ' ' LYS . 6.9 m-20 -84.61 -28.98 26.13 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.33 0.652 . . . . 0.0 110.648 178.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.57 43.74 91.5 Favored Glycine 0 C--N 1.343 0.953 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.447 -172.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.534 ' HD3' ' HB3' ' A' ' 106' ' ' ASP . 58.4 mtpt -134.33 157.62 45.9 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.818 1.247 . . . . 0.0 109.865 -174.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -103.08 107.9 18.87 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.205 0.602 . . . . 0.0 110.047 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.435 ' HB2' HD13 ' A' ' 101' ' ' LEU . 68.8 mt -107.81 -175.55 2.81 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.896 0.878 . . . . 0.0 110.329 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.459 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 19.6 p -110.43 176.67 4.95 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.015 0.526 . . . . 0.0 110.117 173.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . 0.455 ' O ' ' HG2' ' A' ' 116' ' ' GLN . 51.7 t90 -56.99 -42.4 80.21 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.916 0.76 . . . . 0.0 110.87 173.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.459 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 43.8 t -61.05 -36.45 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 123.558 0.743 . . . . 0.0 111.461 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.433 ' HB2' ' HB3' ' A' ' 110' ' ' LEU . 89.5 m -78.14 -21.82 49.71 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.863 176.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.568 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -72.77 -34.92 67.28 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 170.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 112' ' ' TRP . 12.9 mm100 -79.55 -7.47 58.51 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.325 1.05 . . . . 0.0 111.451 177.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 C--N 1.353 0.719 0 C-N-CA 123.237 0.615 . . . . 0.0 110.839 -178.549 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.454 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . . . . . . 0 CA--C 1.534 0.362 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.482 ' SD ' ' SG ' ' A' ' 103' ' ' CYS . 23.7 mtm -144.2 119.01 9.88 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.2 m -121.49 137.71 27.33 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 123.929 0.892 . . . . 0.0 109.44 175.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . 0.649 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 32.5 Cg_endo -61.9 155.26 56.01 Favored 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.425 2.083 . . . . 0.0 112.993 177.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 100' ' ' HIS . 96.7 mt . . . . . 0 N--CA 1.478 0.933 0 C-N-CA 123.404 0.682 . . . . 0.0 110.276 -177.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 . . . . . 0 N--CA 1.469 0.52 0 CA-C-O 121.806 0.812 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -107.79 153.16 23.38 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 113.85 -1.523 . . . . 0.0 109.206 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.8 t -61.82 102.36 0.26 Allowed 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.4 -19.66 64.87 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.291 1.036 . . . . 0.0 113.228 -170.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 19.6 t -66.79 -40.8 86.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.443 0.697 . . . . 0.0 111.124 -178.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.434 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.5 m-70 -104.12 -38.22 7.01 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -177.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.35 37.08 5.2 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-N 114.802 -1.09 . . . . 0.0 112.356 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 1.6 pp20? -132.38 153.76 50.46 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.593 0.757 . . . . 0.0 109.969 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -66.1 133.31 50.46 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.692 0.797 . . . . 0.0 111.101 -173.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.5 pp -98.97 146.38 26.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.499 0.72 . . . . 0.0 110.041 -174.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -145.96 93.27 2.31 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 164.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.505 HD13 ' HB2' ' A' ' 110' ' ' LEU . 2.7 tm? -171.42 138.84 1.21 Allowed 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 173.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -125.84 115.91 20.72 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . 0.619 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 30.5 t -84.54 127.05 33.83 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -71.87 -45.54 60.96 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.779 0.832 . . . . 0.0 110.985 -175.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -69.61 -32.06 70.56 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.042 0.537 . . . . 0.0 111.273 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.619 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 29.4 t70 -94.08 -27.42 16.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.249 1.019 . . . . 0.0 110.818 -171.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.33 34.42 89.87 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-N 115.421 -0.809 . . . . 0.0 113.643 178.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -140.09 162.21 35.77 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.174 0.99 . . . . 0.0 110.084 -175.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -95.96 102.4 14.19 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.747 0.819 . . . . 0.0 110.808 -175.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.505 ' HB2' HD13 ' A' ' 101' ' ' LEU . 74.3 mt -91.54 -176.65 4.57 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.217 1.007 . . . . 0.0 110.499 176.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.4 p -116.29 172.94 6.87 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.15 0.58 . . . . 0.0 110.212 174.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 23.3 t90 -59.41 -47.04 86.98 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.906 0.882 . . . . 0.0 111.781 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 39.8 t -57.86 -39.89 73.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 123.561 0.538 . . . . 0.0 110.821 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 99.0 m -79.28 -26.84 42.29 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.106 0.562 . . . . 0.0 111.632 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.501 ' HB1' ' HG ' ' A' ' 101' ' ' LEU . . . -68.02 -37.09 80.99 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.043 0.537 . . . . 0.0 111.118 177.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -106.42 9.16 31.81 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.18 0.592 . . . . 0.0 111.584 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 44.0 t . . . . . 0 N--CA 1.484 1.244 0 C-N-CA 123.057 0.543 . . . . 0.0 110.248 179.254 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.423 ' HB2' HD11 ' A' ' 101' ' ' LEU . 2.0 ptm -169.78 129.66 0.99 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.017 -175.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.4 m -107.25 149.99 39.4 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 124.724 1.21 . . . . 0.0 109.412 174.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -76.24 140.52 22.24 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 122.432 2.088 . . . . 0.0 112.55 176.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 73.4 mt . . . . . 0 N--CA 1.478 0.974 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 173.309 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 . . . . . 0 C--O 1.241 0.647 0 CA-C-O 121.647 0.737 . . . . 0.0 111.444 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.466 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 85.0 mtt85 -120.37 151.05 39.8 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 114.271 -1.332 . . . . 0.0 110.198 -175.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -65.69 101.66 0.65 Allowed 'General case' 0 C--N 1.348 0.54 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.06 -29.12 67.08 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.821 0.848 . . . . 0.0 112.984 -171.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 47.4 t -57.14 -42.5 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 123.816 0.847 . . . . 0.0 111.756 -177.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -104.68 -35.07 7.93 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 -176.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.07 -3.3 55.37 Favored Glycine 0 N--CA 1.476 1.303 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.387 -175.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -83.44 164.31 19.99 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.077 0.951 . . . . 0.0 111.071 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.466 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 41.3 ttp180 -64.5 150.95 45.65 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.065 0.946 . . . . 0.0 110.429 173.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -117.37 141.37 48.4 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.829 0.452 . . . . 0.0 110.275 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 15.9 m80 -149.24 93.83 2.14 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 166.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' A' ' 110' ' ' LEU . 3.0 tm? -170.43 143.67 2.33 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 170.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -131.2 104.38 7.03 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 176.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 42.0 t -86.03 118.84 25.75 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -76.55 -39.68 52.08 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.225 0.61 . . . . 0.0 111.407 -174.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.16 -38.65 85.82 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.926 0.491 . . . . 0.0 111.34 177.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -81.51 -29.15 33.71 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.184 0.594 . . . . 0.0 110.129 177.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.2 36.1 92.44 Favored Glycine 0 C--N 1.343 0.96 0 CA-C-N 114.815 -1.084 . . . . 0.0 113.398 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -132.22 145.72 51.52 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 124.212 1.005 . . . . 0.0 109.903 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.72 99.74 9.1 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 171.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.512 ' HB2' HD11 ' A' ' 101' ' ' LEU . 83.9 mt -94.76 -176.75 3.97 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.855 0.862 . . . . 0.0 110.533 -178.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.497 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 7.0 p -113.54 164.49 13.57 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 172.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -59.42 -36.21 75.43 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.708 0.803 . . . . 0.0 111.702 178.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.497 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 84.6 t -60.43 -46.03 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 123.233 0.613 . . . . 0.0 111.135 178.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.6 m -78.63 -18.11 54.98 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.692 0.397 . . . . 0.0 111.253 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.33 -41.08 57.6 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.282 0.633 . . . . 0.0 110.201 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -78.76 -17.28 56.05 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.619 0.768 . . . . 0.0 110.803 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.5 t . . . . . 0 C--O 1.241 0.638 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.762 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.652 0 N-CA-C 110.387 -0.227 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 15.4 ptp -132.74 124.41 28.07 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.425 0.69 . . . . 0.0 109.148 167.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.3 m -104.33 136.85 19.12 Favored Pre-proline 0 CA--C 1.552 1.058 0 C-N-CA 123.731 0.813 . . . . 0.0 109.698 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.27 129.86 16.64 Favored 'Trans proline' 0 C--N 1.372 1.787 0 C-N-CA 122.596 2.197 . . . . 0.0 112.206 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 N--CA 1.471 0.606 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.584 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.488 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 82.7 mtp180 -125.61 132.87 52.42 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.849 -175.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -65.89 100.48 0.57 Allowed 'General case' 0 C--N 1.355 0.841 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 176.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.53 -24.61 63.82 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.784 0.834 . . . . 0.0 112.475 -173.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.09 -39.98 87.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 124.268 1.027 . . . . 0.0 111.789 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.481 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 1.9 m-70 -105.51 -31.86 8.78 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.18 -10.66 58.36 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-N 115.12 -0.945 . . . . 0.0 112.539 -175.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.481 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 9.4 pt-20 -73.62 179.34 4.18 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-N 117.429 0.615 . . . . 0.0 110.31 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.488 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 33.5 mtp-105 -69.54 -178.98 1.56 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.689 0.795 . . . . 0.0 111.899 172.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 pp -150.93 145.35 25.55 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.977 173.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 12.7 m170 -152.84 92.95 1.7 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 164.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.53 HD13 ' HB2' ' A' ' 110' ' ' LEU . 2.6 tm? -170.45 146.76 2.87 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.433 ' N ' HD12 ' A' ' 101' ' ' LEU . 60.2 t80 -140.36 108.53 5.77 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . 0.657 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 43.6 t -79.77 143.02 34.83 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -76.97 -39.98 48.57 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.281 0.632 . . . . 0.0 111.638 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -79.55 -46.42 17.37 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.436 0.294 . . . . 0.0 111.392 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.657 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 32.1 t70 -66.16 -31.74 72.77 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.173 0.589 . . . . 0.0 109.916 178.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.28 16.18 62.17 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.044 -0.98 . . . . 0.0 114.39 173.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -128.22 168.5 15.37 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.744 0.818 . . . . 0.0 109.257 -178.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -83.64 104.44 13.76 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.957 -1.019 . . . . 0.0 110.474 -177.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.53 ' HB2' HD13 ' A' ' 101' ' ' LEU . 82.9 mt -91.22 -179.01 5.31 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.7 0.8 . . . . 0.0 110.656 174.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.556 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 8.8 p -117.92 162.77 17.59 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 171.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -59.9 -33.89 72.45 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.72 0.808 . . . . 0.0 112.112 178.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.556 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 57.7 t -58.91 -44.0 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 C-N-CA 123.36 0.664 . . . . 0.0 110.786 175.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.46 -29.06 61.31 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.465 0.706 . . . . 0.0 111.018 177.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.417 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -67.51 -35.21 78.68 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.965 0.506 . . . . 0.0 111.241 178.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -78.03 -26.96 48.71 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.406 0.682 . . . . 0.0 111.111 177.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.9 t . . . . . 0 C--N 1.35 0.611 0 C-N-CA 123.286 0.634 . . . . 0.0 110.934 -177.135 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.686 0 CA-C-O 121.933 0.873 . . . . 0.0 109.586 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.1 ptp -148.23 156.47 42.6 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.096 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 31.4 m -125.9 147.07 57.62 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 124.644 1.177 . . . . 0.0 109.67 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.7 128.71 10.35 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 122.203 1.936 . . . . 0.0 112.069 174.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 57.6 mt . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 174.289 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.427 ' HG3' ' HA ' ' A' ' 98' ' ' ARG . 0.0 OUTLIER -122.83 138.34 54.67 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.46 0.704 . . . . 0.0 111.078 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.8 t -67.5 101.35 0.97 Allowed 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 169.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.08 -14.59 60.86 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -167.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 77.9 t -68.34 -46.03 81.48 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 123.059 0.544 . . . . 0.0 111.032 175.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -99.42 -39.54 8.32 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.005 0.431 . . . . 0.0 110.664 -174.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.62 2.52 53.08 Favored Glycine 0 CA--C 1.534 1.25 0 CA-C-N 115.4 -0.818 . . . . 0.0 113.16 -172.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -82.05 152.49 26.6 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 117.307 0.554 . . . . 0.0 109.702 177.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.427 ' HA ' ' HG3' ' A' ' 91' ' ' ARG . 54.1 ttp180 -70.09 119.71 14.69 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 123.561 0.744 . . . . 0.0 109.13 174.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -76.49 136.46 39.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -177.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.3 m80 -154.0 93.82 1.68 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.804 0.841 . . . . 0.0 109.234 172.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.496 HD12 ' HE2' ' A' ' 125' ' ' MET . 3.1 tm? -171.44 150.03 2.79 Favored 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 170.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.459 ' N ' HD13 ' A' ' 101' ' ' LEU . 61.2 t80 -138.68 110.94 7.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 48.6 t -84.19 139.64 32.26 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -73.33 -53.65 10.28 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 122.723 0.409 . . . . 0.0 110.665 -174.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.565 ' HB3' ' HZ1' ' A' ' 105' ' ' LYS . 0.4 OUTLIER -63.97 -34.88 78.99 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.454 0.702 . . . . 0.0 112.513 -179.231 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.456 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 30.3 t0 -82.83 -33.02 27.26 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 -177.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.36 25.71 67.1 Favored Glycine 0 C--N 1.351 1.397 0 CA-C-N 115.349 -0.842 . . . . 0.0 113.631 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -120.25 150.3 40.9 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.132 0.973 . . . . 0.0 109.901 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.26 100.52 11.27 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.149 176.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 28.4 mt -90.93 -178.24 5.16 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.344 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.6 p -112.76 178.08 4.41 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 46.8 t90 -63.41 -51.11 67.17 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.401 0.438 . . . . 0.0 111.872 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 97.5 t -61.7 -45.89 97.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 C-N-CA 123.287 0.635 . . . . 0.0 112.175 -174.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 96.7 m -68.99 -25.3 64.45 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 122.738 0.415 . . . . 0.0 111.838 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.96 -51.74 6.9 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 123.113 0.565 . . . . 0.0 111.227 -175.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -81.3 -10.85 59.49 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.734 -172.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 33.5 t . . . . . 0 CA--C 1.537 0.472 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 161.413 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.617 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.496 ' HE2' HD12 ' A' ' 101' ' ' LEU . 15.4 ptm -163.29 117.62 1.63 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.794 0.838 . . . . 0.0 109.409 -170.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 30.2 m -92.05 135.36 27.28 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 122.955 0.502 . . . . 0.0 109.995 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.26 120.65 6.07 Favored 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 122.26 1.974 . . . . 0.0 111.671 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 98.7 mt . . . . . 0 N--CA 1.472 0.625 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 169.99 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.567 ' HG2' ' HD2' ' A' ' 98' ' ' ARG . 69.4 mtt180 -127.69 136.44 51.58 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.913 0.885 . . . . 0.0 109.922 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.1 t -72.71 100.41 2.82 Favored 'General case' 0 C--N 1.354 0.792 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 175.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.78 -30.12 71.25 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.877 0.871 . . . . 0.0 111.861 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 67.8 t -52.46 -40.5 32.82 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 124.961 1.305 . . . . 0.0 112.314 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -103.99 -37.84 7.21 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.46 24.33 18.94 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 114.953 -1.022 . . . . 0.0 111.815 -171.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -103.33 178.72 4.47 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.567 ' HD2' ' HG2' ' A' ' 91' ' ' ARG . 4.7 tpt180 -74.93 166.26 23.94 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 123.759 0.824 . . . . 0.0 109.953 173.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.5 pp -133.6 134.7 43.59 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.526 -0.734 . . . . 0.0 110.594 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.594 ' HA ' HD13 ' A' ' 128' ' ' LEU . 78.7 m-70 -142.17 95.45 2.8 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 166.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.549 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -171.95 154.81 3.61 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 170.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -135.4 116.09 13.9 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 28.8 t -85.65 124.18 31.9 Favored 'General case' 0 C--N 1.346 0.416 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -73.71 -44.93 55.08 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.408 0.683 . . . . 0.0 110.969 -173.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.408 ' HB3' ' HZ1' ' A' ' 105' ' ' LYS . 0.2 OUTLIER -75.3 -40.65 58.35 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.644 -178.593 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -78.2 -31.91 49.69 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.253 0.621 . . . . 0.0 110.067 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.18 -19.61 25.82 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.619 -0.719 . . . . 0.0 114.538 174.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -88.24 144.13 26.62 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 117.712 0.756 . . . . 0.0 111.45 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.418 ' HB2' HD11 ' A' ' 128' ' ' LEU . . . -73.4 114.81 12.03 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.738 174.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.486 ' HB2' HD12 ' A' ' 101' ' ' LEU . 82.9 mt -98.93 179.19 4.71 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.74 0.816 . . . . 0.0 110.706 -178.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 8.2 p -99.61 164.1 12.21 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 168.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 63.1 t90 -62.62 -36.01 81.41 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 123.42 0.45 . . . . 0.0 111.325 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 85.0 t -59.77 -40.56 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 C-N-CA 123.256 0.623 . . . . 0.0 111.357 176.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 66.8 m -74.68 -20.81 59.72 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.793 0.437 . . . . 0.0 111.157 177.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.549 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -74.85 -44.0 51.46 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.269 0.628 . . . . 0.0 110.968 176.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -96.24 5.71 50.42 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.983 0.913 . . . . 0.0 111.759 -176.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.245 0.84 0 C-N-CA 123.682 0.793 . . . . 0.0 110.99 -176.468 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.735 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 17.6 ptp -155.26 135.4 13.06 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.593 0.757 . . . . 0.0 110.888 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.9 m -114.36 149.98 43.02 Favored Pre-proline 0 N--CA 1.479 0.99 0 C-N-CA 124.665 1.186 . . . . 0.0 108.893 171.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.89 152.19 77.4 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.295 1.997 . . . . 0.0 111.89 173.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.594 HD13 ' HA ' ' A' ' 100' ' ' HIS . 63.8 mt . . . . . 0 N--CA 1.477 0.9 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 170.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 . . . . . 0 N--CA 1.48 1.027 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 46.3 mtm180 -132.69 136.4 46.41 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.777 0.831 . . . . 0.0 111.003 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -74.51 106.42 6.1 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 173.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.68 -17.67 64.12 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -172.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.5 t -67.88 -35.15 71.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.007 0.523 . . . . 0.0 111.359 178.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -107.29 -37.62 6.2 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.196 0.522 . . . . 0.0 109.805 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.18 29.64 12.26 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.058 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -104.72 168.38 9.11 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.281 1.032 . . . . 0.0 109.717 176.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -72.99 124.31 25.22 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 167.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.2 pp -75.91 138.46 41.05 Favored 'General case' 0 C--N 1.357 0.923 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -149.84 94.29 2.15 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.123 0.569 . . . . 0.0 109.531 173.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.536 HD12 ' HB2' ' A' ' 125' ' ' MET . 2.4 tm? -172.24 143.38 1.47 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 105.827 -1.916 . . . . 0.0 105.827 170.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -127.61 113.62 16.32 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 175.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . 0.542 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 48.8 t -83.29 129.75 35.02 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -178.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -75.01 -41.42 59.42 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.422 0.689 . . . . 0.0 111.452 -175.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.6 ' HB2' ' HZ3' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -73.89 -39.57 63.8 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 120.901 0.382 . . . . 0.0 111.113 -179.654 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.542 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 26.4 t70 -80.6 -30.34 36.83 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.924 0.89 . . . . 0.0 110.687 -178.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.02 8.57 64.86 Favored Glycine 0 C--N 1.343 0.937 0 CA-C-N 115.552 -0.749 . . . . 0.0 114.449 176.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -116.92 -179.71 3.77 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.606 0.763 . . . . 0.0 109.925 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -103.01 109.86 21.56 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.613 0.765 . . . . 0.0 112.084 -172.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.7 mt -93.3 -175.58 3.87 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.857 0.863 . . . . 0.0 110.427 173.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.563 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 0.7 OUTLIER -111.84 149.51 31.7 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 164.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -60.33 -28.45 68.16 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.933 0.493 . . . . 0.0 112.006 -176.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.563 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 71.2 t -61.96 -42.06 93.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.388 0.675 . . . . 0.0 111.277 175.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 89.8 m -75.81 -17.61 59.79 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.009 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.417 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -77.7 -36.88 50.66 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.988 0.515 . . . . 0.0 110.58 169.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -84.57 -3.89 58.69 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.538 0.735 . . . . 0.0 111.414 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.47 0.541 0 C-N-CA 123.641 0.777 . . . . 0.0 109.435 169.8 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.536 ' HB2' HD12 ' A' ' 101' ' ' LEU . 8.2 ptm -155.27 112.33 3.29 Favored 'General case' 0 CA--C 1.555 1.146 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.407 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 34.3 m -96.85 138.63 21.34 Favored Pre-proline 0 N--CA 1.491 1.618 0 C-N-CA 123.502 0.721 . . . . 0.0 111.38 -175.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . 0.415 ' HA ' HD22 ' A' ' 101' ' ' LEU . 58.2 Cg_endo -70.26 123.55 10.04 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.784 2.323 . . . . 0.0 114.312 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 82.7 mt . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 167.545 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 . . . . . 0 N--CA 1.478 0.931 0 CA-C-O 122.266 1.032 . . . . 0.0 108.719 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.504 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 54.2 mtt180 -134.6 136.9 43.26 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.347 -169.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 2.4 t -70.16 99.97 1.58 Allowed 'General case' 0 C--N 1.35 0.595 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 174.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.83 -20.77 65.2 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.451 0.7 . . . . 0.0 112.55 -170.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 50.8 t -63.26 -47.5 91.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 124.042 0.937 . . . . 0.0 111.042 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.519 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 0.8 OUTLIER -93.81 -28.2 16.02 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.727 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.53 27.82 31.54 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.115 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.519 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 9.8 pt-20 -110.27 169.93 8.42 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.835 1.254 . . . . 0.0 108.748 173.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.504 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 45.3 mtm105 -67.89 168.76 11.04 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 121.327 0.584 . . . . 0.0 110.523 168.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -124.72 136.74 54.14 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.99 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.528 ' HA ' HD11 ' A' ' 128' ' ' LEU . 75.2 m-70 -143.89 94.02 2.53 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 167.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.728 ' HG ' ' HB3' ' A' ' 115' ' ' ALA . 1.8 tm? -171.59 151.56 2.98 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.872 1.669 . . . . 0.0 106.52 171.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.46 ' N ' HD11 ' A' ' 101' ' ' LEU . 38.9 t80 -141.54 124.95 16.59 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 73.4 m -82.3 123.24 28.89 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.163 0.585 . . . . 0.0 109.991 175.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.593 ' HB2' ' HB2' ' A' ' 124' ' ' ALA . 10.9 mm-40 -74.88 -30.06 61.19 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 121.286 0.565 . . . . 0.0 111.416 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -89.78 -38.85 13.51 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.659 -176.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -89.72 -31.33 17.51 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.434 0.694 . . . . 0.0 110.743 -178.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.82 41.39 49.69 Favored Glycine 0 C--N 1.342 0.867 0 CA-C-N 115.741 -0.663 . . . . 0.0 113.779 177.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -133.05 144.43 50.02 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.461 0.704 . . . . 0.0 110.777 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.27 100.75 11.43 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.306 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 66.9 mt -92.02 -177.41 4.69 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.448 0.699 . . . . 0.0 110.322 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 5.6 p -103.35 165.79 10.82 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 168.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 49.6 t90 -64.71 -29.85 70.85 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.213 0.605 . . . . 0.0 111.724 -179.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.35 -39.68 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 122.839 0.456 . . . . 0.0 110.756 177.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 96.9 m -76.05 -17.09 59.8 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.021 0.529 . . . . 0.0 111.426 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.728 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -75.52 -49.1 19.73 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.213 0.605 . . . . 0.0 110.94 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -85.48 -28.23 25.15 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.441 -173.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 CA--C 1.544 0.744 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 166.328 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.593 ' HB2' ' HB2' ' A' ' 104' ' ' GLU . . . . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 121.623 0.725 . . . . 0.0 112.119 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.402 ' HB3' HD13 ' A' ' 101' ' ' LEU . 52.7 mmm -127.07 112.38 15.13 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.788 1.235 . . . . 0.0 108.097 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 33.2 m -116.37 151.39 46.83 Favored Pre-proline 0 N--CA 1.493 1.707 0 C-N-CA 123.47 0.708 . . . . 0.0 110.575 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -78.97 137.81 14.11 Favored 'Trans proline' 0 C--N 1.375 1.925 0 C-N-CA 122.719 2.28 . . . . 0.0 113.122 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.528 HD11 ' HA ' ' A' ' 100' ' ' HIS . 60.7 mt . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 171.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 . . . . . 0 N--CA 1.494 1.755 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -126.39 128.52 47.17 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.837 0.855 . . . . 0.0 109.313 -178.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.4 t -68.59 100.64 1.15 Allowed 'General case' 0 C--N 1.349 0.573 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 174.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.06 -19.82 63.32 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.995 0.918 . . . . 0.0 112.496 -175.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.2 t -62.81 -38.68 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.096 0 C-N-CA 124.173 0.989 . . . . 0.0 111.434 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.422 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 2.1 m-70 -108.09 -39.27 5.55 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 120.88 0.371 . . . . 0.0 110.094 -177.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.42 52.3 2.37 Favored Glycine 0 C--N 1.347 1.166 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.138 -170.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.422 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.0 OUTLIER -146.69 161.21 41.07 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.501 1.12 . . . . 0.0 108.774 176.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 60.5 ttt85 -73.6 139.74 45.74 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.335 0.654 . . . . 0.0 110.995 -178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -105.44 137.16 43.72 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.216 1.007 . . . . 0.0 110.397 -176.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -141.02 93.29 2.57 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 165.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.47 HD12 ' N ' ' A' ' 102' ' ' PHE . 1.6 tm? -172.07 155.7 3.8 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 170.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.47 ' N ' HD12 ' A' ' 101' ' ' LEU . 33.0 t80 -153.5 121.55 6.11 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 171.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . 0.639 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 46.4 t -96.02 130.65 42.97 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 176.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -67.05 -47.9 69.92 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.612 0.765 . . . . 0.0 110.903 -175.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -75.96 -35.58 59.61 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -177.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.639 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 10.1 t70 -70.69 -33.11 70.55 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 176.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.42 30.85 78.82 Favored Glycine 0 C--N 1.342 0.902 0 CA-C-N 114.875 -1.057 . . . . 0.0 114.55 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -130.25 149.59 51.88 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.484 0.714 . . . . 0.0 109.585 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.98 100.27 9.6 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.652 -0.869 . . . . 0.0 108.652 174.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 75.5 mt -88.46 176.12 7.31 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.312 -176.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.47 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 12.6 p -115.28 173.13 6.67 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 172.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -59.21 -40.38 85.59 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 123.227 0.329 . . . . 0.0 111.358 176.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.47 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 59.2 t -61.65 -43.5 97.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.494 0.718 . . . . 0.0 111.484 -178.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.1 m -78.72 -18.22 54.64 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.442 0.297 . . . . 0.0 111.282 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.91 -43.94 33.69 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.412 0.685 . . . . 0.0 110.677 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -77.53 -16.92 58.4 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.337 0.655 . . . . 0.0 110.59 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 19.5 t . . . . . 0 CA--C 1.546 0.808 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 172.65 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.923 0 CA-C-O 121.909 0.861 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.468 ' HB3' HD11 ' A' ' 101' ' ' LEU . 90.0 mtp -101.74 106.46 17.47 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 21.1 m -104.77 149.37 37.42 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 124.281 1.032 . . . . 0.0 109.924 -177.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.01 151.4 50.11 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 122.097 1.864 . . . . 0.0 111.092 172.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 45.7 mt . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 121.478 0.656 . . . . 0.0 110.503 177.967 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 121.155 0.502 . . . . 0.0 110.913 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -123.51 138.47 54.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.433 0.693 . . . . 0.0 110.739 -176.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.2 t -69.45 102.62 1.83 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.697 0.799 . . . . 0.0 108.967 174.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.8 -8.32 47.22 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.971 0.908 . . . . 0.0 113.148 -173.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 55.0 t -75.07 -38.92 43.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 C-N-CA 123.385 0.674 . . . . 0.0 111.042 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -106.67 -37.25 6.48 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 -176.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.89 32.8 6.64 Favored Glycine 0 N--CA 1.474 1.201 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.092 -173.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -118.74 167.01 12.08 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.608 1.163 . . . . 0.0 109.282 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -71.7 144.32 49.36 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.306 0.643 . . . . 0.0 109.45 172.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -106.33 136.82 45.39 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -144.49 95.4 2.7 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 167.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.441 HD12 ' HE3' ' A' ' 125' ' ' MET . 2.9 tm? -170.35 146.69 2.91 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 170.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.422 ' HB2' HD22 ' A' ' 128' ' ' LEU . 39.1 t80 -140.16 112.96 8.09 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 69.7 m -66.81 115.46 6.62 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.656 0.783 . . . . 0.0 110.231 173.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -69.24 -29.77 67.76 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.014 0.525 . . . . 0.0 111.537 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -84.12 -48.27 10.03 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.139 0.576 . . . . 0.0 111.42 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.91 -16.85 29.13 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.218 0.607 . . . . 0.0 111.073 -170.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.63 35.07 89.34 Favored Glycine 0 C--N 1.347 1.163 0 C-N-CA 123.573 0.606 . . . . 0.0 114.456 175.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -129.45 149.41 51.24 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.634 0.774 . . . . 0.0 110.48 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -95.28 103.05 14.9 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.453 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.6 mt -94.36 -179.3 4.87 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.516 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 10.6 p -111.43 173.81 6.17 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 171.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 32.2 t90 -59.07 -42.14 89.68 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.159 0.584 . . . . 0.0 111.5 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.75 -41.49 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.212 0 C-N-CA 123.565 0.746 . . . . 0.0 111.714 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.3 m -78.52 -14.05 59.54 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 122.58 0.352 . . . . 0.0 111.147 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.403 ' HB1' ' HG ' ' A' ' 101' ' ' LEU . . . -80.67 -49.27 11.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.255 0.622 . . . . 0.0 110.475 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -75.52 -16.94 60.23 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.008 0.923 . . . . 0.0 112.002 -173.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.2 p . . . . . 0 N--CA 1.482 1.171 0 C-N-CA 123.427 0.691 . . . . 0.0 111.789 179.42 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.879 0 CA-C-O 121.421 0.629 . . . . 0.0 111.99 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.441 ' HE3' HD12 ' A' ' 101' ' ' LEU . 21.3 ptm -157.63 116.0 3.15 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.357 -176.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.4 m -103.65 150.03 37.7 Favored Pre-proline 0 N--CA 1.483 1.205 0 C-N-CA 123.843 0.857 . . . . 0.0 110.31 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -80.52 139.6 12.87 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 122.163 1.909 . . . . 0.0 111.698 174.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.422 HD22 ' HB2' ' A' ' 102' ' ' PHE . 74.9 mt . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.977 0.417 . . . . 0.0 110.087 178.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 N--CA 1.473 0.724 0 CA-C-O 121.22 0.533 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 65.8 mtm180 -132.28 134.86 45.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.593 1.157 . . . . 0.0 109.578 -175.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -69.09 101.78 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 171.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.51 -7.16 48.61 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.58 0.752 . . . . 0.0 112.603 -172.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -67.25 -50.93 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 123.484 0.714 . . . . 0.0 110.221 174.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -95.06 -36.99 11.31 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.655 -176.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.48 42.62 4.18 Favored Glycine 0 C--N 1.347 1.149 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.029 -175.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -126.45 156.63 40.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.155 0.982 . . . . 0.0 109.648 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -67.53 128.62 37.12 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.875 0.87 . . . . 0.0 109.771 172.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 pp -97.51 143.56 28.09 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 122.945 0.498 . . . . 0.0 110.565 -178.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -147.55 96.09 2.63 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 164.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.498 ' HG ' ' HB3' ' A' ' 115' ' ' ALA . 2.5 tm? -170.26 151.8 3.95 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 106.164 -1.791 . . . . 0.0 106.164 169.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.437 ' N ' HD12 ' A' ' 101' ' ' LEU . 32.7 t80 -137.15 115.84 12.12 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 175.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . 0.623 ' HB3' ' HB2' ' A' ' 106' ' ' ASP . 6.4 t -78.59 134.84 37.17 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.487 ' HB2' ' HB3' ' A' ' 124' ' ' ALA . 13.9 mm-40 -77.26 -40.14 45.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.774 0.43 . . . . 0.0 111.113 177.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -74.68 -42.01 59.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.674 0.389 . . . . 0.0 111.181 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.623 ' HB2' ' HB3' ' A' ' 103' ' ' CYS . 1.9 m-20 -81.3 -25.22 36.66 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.999 0.92 . . . . 0.0 110.958 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.23 25.14 69.51 Favored Glycine 0 C--N 1.355 1.611 0 O-C-N 123.383 0.427 . . . . 0.0 113.84 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -132.5 153.98 50.38 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.265 0.626 . . . . 0.0 110.705 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.66 103.41 7.58 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.822 0.849 . . . . 0.0 110.666 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 84.1 mt -94.43 -177.78 4.36 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.109 0.964 . . . . 0.0 110.861 176.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.492 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 4.7 p -112.12 162.59 15.26 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -53.02 -40.43 63.87 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.362 0.665 . . . . 0.0 112.401 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.492 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 62.1 t -60.6 -44.41 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 C-N-CA 123.676 0.79 . . . . 0.0 111.266 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.8 m -79.86 -19.45 48.3 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 122.586 0.354 . . . . 0.0 111.739 177.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.498 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -71.18 -53.73 13.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.359 0.664 . . . . 0.0 110.987 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -75.65 -14.6 60.37 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.257 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--N 1.356 0.88 0 C-N-CA 123.662 0.785 . . . . 0.0 109.126 174.094 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.487 ' HB3' ' HB2' ' A' ' 104' ' ' GLU . . . . . . . . 0 CA--C 1.541 0.607 0 CA-C-O 120.999 0.428 . . . . 0.0 110.43 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.3 ptp -159.18 151.13 20.81 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.141 0.977 . . . . 0.0 109.755 176.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 34.7 m -125.62 142.18 41.22 Favored Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 124.37 1.068 . . . . 0.0 109.336 176.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -73.65 126.11 10.57 Favored 'Trans proline' 0 C--N 1.373 1.867 0 C-N-CA 122.037 1.825 . . . . 0.0 111.981 176.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 49.0 mt . . . . . 0 N--CA 1.473 0.684 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 172.434 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 122.175 0.988 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.429 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 94.0 mtt180 -120.57 138.23 53.99 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 114.66 -1.155 . . . . 0.0 109.679 173.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -68.98 102.18 1.54 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 173.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.29 -20.52 62.99 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -169.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.5 t -67.24 -47.08 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.226 0.611 . . . . 0.0 111.13 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.547 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.0 OUTLIER -93.62 -38.66 11.23 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -177.079 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.69 36.92 6.64 Favored Glycine 0 C--N 1.35 1.357 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.889 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.547 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.4 OUTLIER -127.86 166.2 18.71 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.059 0.944 . . . . 0.0 109.97 176.453 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.429 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 2.9 tpt180 -71.17 124.87 25.44 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.217 1.007 . . . . 0.0 110.869 -173.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.8 pp -89.19 131.62 35.23 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 178.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -149.96 96.76 2.49 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.259 1.024 . . . . 0.0 108.612 165.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.529 ' HG ' ' HB3' ' A' ' 115' ' ' ALA . 3.1 tm? -168.74 149.76 4.64 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 174.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -139.17 118.01 12.4 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . 0.6 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 42.4 t -84.44 123.74 30.57 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 172.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -62.32 -46.93 86.53 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.864 0.865 . . . . 0.0 112.868 -169.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -87.84 -29.84 20.63 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -177.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.6 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 27.2 t70 -72.81 -32.86 65.84 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-O 121.049 0.452 . . . . 0.0 110.586 178.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.46 18.59 73.72 Favored Glycine 0 C--N 1.34 0.783 0 CA-C-N 115.274 -0.875 . . . . 0.0 115.214 173.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -112.53 153.07 28.06 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 117.825 0.813 . . . . 0.0 110.032 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.48 101.03 13.52 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.792 -1.094 . . . . 0.0 108.416 178.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.512 ' HB2' HD12 ' A' ' 101' ' ' LEU . 27.8 mt -91.8 -176.97 4.62 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.096 0.959 . . . . 0.0 109.554 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.625 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 2.9 p -111.19 158.82 18.49 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 171.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -60.9 -33.62 73.4 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.413 0.685 . . . . 0.0 110.997 178.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.625 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 60.4 t -58.55 -43.04 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 C-N-CA 123.585 0.754 . . . . 0.0 111.331 177.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 69.1 m -72.74 -29.87 63.69 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.728 177.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.529 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -68.56 -48.02 65.34 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.276 0.63 . . . . 0.0 111.244 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -78.03 -9.31 59.06 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.579 0.752 . . . . 0.0 112.018 -176.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 39.1 t . . . . . 0 C--O 1.247 0.948 0 C-N-CA 123.475 0.71 . . . . 0.0 109.894 174.249 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 120.922 0.392 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.6 ptp -141.73 132.42 25.59 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.499 178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.5 m -112.13 144.46 30.81 Favored Pre-proline 0 N--CA 1.481 1.119 0 C-N-CA 124.999 1.32 . . . . 0.0 109.9 177.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.64 147.08 50.49 Favored 'Trans proline' 0 C--N 1.375 1.922 0 C-N-CA 122.538 2.159 . . . . 0.0 112.258 178.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 69.9 mt . . . . . 0 N--CA 1.476 0.831 0 C-N-CA 123.142 0.577 . . . . 0.0 109.824 177.935 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 N--CA 1.475 0.796 0 CA-C-O 121.068 0.461 . . . . 0.0 110.007 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -128.3 127.88 43.58 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.905 0.882 . . . . 0.0 109.918 -177.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -68.86 103.29 1.75 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.63 -23.5 51.49 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -168.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 46.3 t -59.8 -44.98 95.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.528 0.731 . . . . 0.0 111.549 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -104.84 -38.75 6.54 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -172.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.09 -6.46 58.24 Favored Glycine 0 C--N 1.349 1.252 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.533 -170.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -67.46 165.0 17.56 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.946 0.898 . . . . 0.0 110.205 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.91 132.68 43.79 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 170.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 pp -92.66 129.58 38.55 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 178.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -147.96 95.01 2.42 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 171.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.434 HD11 ' HE2' ' A' ' 125' ' ' MET . 2.9 tm? -171.14 121.32 0.53 Allowed 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 173.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -96.62 111.39 23.55 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 172.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 38.2 t -87.31 108.34 18.92 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -73.64 -19.97 60.7 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -174.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.545 ' HE3' ' SD ' ' A' ' 125' ' ' MET . 21.5 pttp -84.89 -36.43 21.5 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.253 0.621 . . . . 0.0 111.038 177.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -87.69 -26.9 22.74 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.297 0.639 . . . . 0.0 110.048 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.93 17.41 71.54 Favored Glycine 0 C--N 1.343 0.933 0 CA-C-N 115.015 -0.993 . . . . 0.0 113.804 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.405 ' HA ' ' HE3' ' A' ' 108' ' ' LYS . 0.0 OUTLIER -122.71 170.31 10.18 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 123.733 0.813 . . . . 0.0 110.181 -179.243 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.43 108.15 20.07 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.124 -173.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.1 mt -100.9 -177.2 3.39 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.711 1.204 . . . . 0.0 111.334 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.0 p -112.9 161.57 16.83 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 43.2 t90 -54.66 -44.15 73.01 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.025 0.93 . . . . 0.0 112.038 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.6 t -60.45 -41.0 85.96 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.661 0.785 . . . . 0.0 111.586 -176.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 97.1 m -75.37 -26.1 58.22 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.653 0.381 . . . . 0.0 111.594 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.65 -36.0 62.85 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.19 0.596 . . . . 0.0 111.001 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -94.92 -2.66 50.14 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.602 0.761 . . . . 0.0 111.715 -178.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 CA--C 1.551 1.018 0 C-N-CA 123.66 0.784 . . . . 0.0 111.41 -178.265 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.759 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.545 ' SD ' ' HE3' ' A' ' 105' ' ' LYS . 72.8 mtp -129.33 107.24 9.37 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 178.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 33.9 m -91.22 161.69 34.3 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.06 0.944 . . . . 0.0 110.006 -173.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -76.11 167.75 25.38 Favored 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 122.173 1.915 . . . . 0.0 112.28 174.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 15.5 mt . . . . . 0 N--CA 1.485 1.277 0 C-N-CA 123.64 0.776 . . . . 0.0 111.411 -177.484 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.404 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.521 0.677 . . . . 0.0 110.66 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 84.9 mtt85 -110.04 132.38 54.22 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.578 -0.701 . . . . 0.0 110.638 -178.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -62.47 103.06 0.37 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.965 1.306 . . . . 0.0 109.517 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.02 -15.7 35.01 Favored 'General case' 0 N--CA 1.486 1.333 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -166.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 97.8 t -74.61 -43.97 47.38 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 123.16 0.584 . . . . 0.0 111.335 177.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -100.28 -39.91 7.79 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.222 0.534 . . . . 0.0 110.603 -173.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.05 -10.71 60.29 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.555 -168.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -74.28 145.78 43.72 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.632 0.773 . . . . 0.0 109.856 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 58.3 ttp180 -62.5 144.19 56.3 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.663 0.785 . . . . 0.0 110.894 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 2.7 pp -109.48 141.75 41.48 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 123.635 0.774 . . . . 0.0 110.498 -175.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -148.61 94.46 2.28 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 164.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.462 HD21 ' SD ' ' A' ' 125' ' ' MET . 1.5 tp -170.01 158.55 7.18 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.082 1.353 . . . . 0.0 108.363 172.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.424 ' H ' ' HG ' ' A' ' 101' ' ' LEU . 67.4 t80 -138.05 109.79 7.11 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.831 0.852 . . . . 0.0 109.892 177.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 97.4 m -65.61 110.89 2.91 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.737 0.815 . . . . 0.0 108.966 168.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -76.13 -32.55 59.18 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.876 0.87 . . . . 0.0 110.919 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.536 ' HB3' ' HB1' ' A' ' 124' ' ' ALA . 15.2 ptmm? -81.58 -11.94 58.95 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.487 -176.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -131.32 -27.82 1.95 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.614 0.366 . . . . 0.0 111.036 -172.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.96 40.34 21.44 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 116.084 -0.507 . . . . 0.0 113.592 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -120.02 153.61 35.78 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.822 0.849 . . . . 0.0 110.253 179.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.97 106.97 17.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.245 0.618 . . . . 0.0 109.729 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.7 mt -107.14 -175.74 2.88 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.469 0.707 . . . . 0.0 109.832 178.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.574 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 19.9 p -105.4 167.02 10.02 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 171.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 65.9 t90 -56.56 -36.27 69.13 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 124.236 1.015 . . . . 0.0 111.798 173.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.574 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 60.1 t -59.53 -37.53 70.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 123.479 0.712 . . . . 0.0 111.385 176.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 59.4 m -72.78 -23.32 60.79 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.894 0.478 . . . . 0.0 110.993 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -87.9 -1.94 58.3 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.599 0.76 . . . . 0.0 111.717 173.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -120.22 12.82 11.88 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.358 0.663 . . . . 0.0 110.398 173.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 42.9 t . . . . . 0 C--O 1.243 0.761 0 C-N-CA 124.33 1.052 . . . . 0.0 111.916 -175.353 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.536 ' HB1' ' HB3' ' A' ' 105' ' ' LYS . . . . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 121.063 0.459 . . . . 0.0 109.881 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.462 ' SD ' HD21 ' A' ' 101' ' ' LEU . 15.0 ptp -156.03 129.71 8.42 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 124.36 1.064 . . . . 0.0 109.255 -178.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.4 m -106.29 134.33 19.83 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 123.559 0.744 . . . . 0.0 109.895 175.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.85 120.32 7.24 Favored 'Trans proline' 0 C--N 1.368 1.589 0 C-N-CA 122.309 2.006 . . . . 0.0 110.625 174.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.5 mt . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.707 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 121.284 0.564 . . . . 0.0 110.584 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -122.4 134.09 54.62 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 125.749 1.62 . . . . 0.0 108.652 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 111' ' ' CYS . 18.8 t -64.61 103.26 0.65 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.0 -19.32 12.14 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -169.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.4 t -69.17 -51.29 44.86 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 123.368 0.667 . . . . 0.0 111.13 179.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -95.39 -38.4 10.51 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.008 0.432 . . . . 0.0 110.14 -173.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.16 17.79 36.05 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.413 -0.812 . . . . 0.0 113.759 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.414 ' OE2' ' HB3' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -105.4 166.72 10.23 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 117.676 0.738 . . . . 0.0 110.012 174.055 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -68.71 123.99 22.43 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.513 1.125 . . . . 0.0 110.633 -175.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.1 pp -90.7 131.07 36.6 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.495 0.718 . . . . 0.0 109.125 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -143.84 93.77 2.5 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 165.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.606 ' HG ' ' HB1' ' A' ' 115' ' ' ALA . 2.7 tm? -170.11 150.81 3.8 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 170.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.425 ' N ' HD11 ' A' ' 101' ' ' LEU . 84.1 t80 -144.52 110.43 5.39 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 176.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 43.9 t -86.28 112.85 21.78 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 178.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -73.6 -31.37 63.54 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.098 0.959 . . . . 0.0 111.596 -176.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.631 ' HB2' ' HZ3' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -78.83 -45.13 21.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.854 0.462 . . . . 0.0 111.111 177.951 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -79.89 -22.93 42.22 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.622 0.769 . . . . 0.0 109.985 -177.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.72 40.57 93.92 Favored Glycine 0 C--N 1.344 1.027 0 C-N-CA 123.905 0.764 . . . . 0.0 114.146 177.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -132.69 138.78 47.39 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.658 0.783 . . . . 0.0 110.61 177.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.04 100.21 8.06 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 169.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.563 ' HB2' HD12 ' A' ' 101' ' ' LEU . 83.7 mt -95.28 -178.47 4.46 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.67 0.788 . . . . 0.0 111.02 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.458 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 13.7 p -110.74 173.06 6.51 Favored 'General case' 0 C--O 1.244 0.792 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 172.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -59.34 -38.7 81.03 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.158 0.583 . . . . 0.0 111.617 175.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.458 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 41.7 t -62.72 -43.04 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 C-N-CA 123.529 0.731 . . . . 0.0 111.101 -178.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.8 m -78.71 -15.54 58.34 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.072 0.549 . . . . 0.0 111.45 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.606 ' HB1' ' HG ' ' A' ' 101' ' ' LEU . . . -78.74 -33.27 46.75 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.38 0.672 . . . . 0.0 110.331 173.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -80.57 -27.16 37.54 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.722 0.809 . . . . 0.0 110.274 175.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--N 1.351 0.659 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.346 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.195 0 CA-C-O 121.11 0.481 . . . . 0.0 111.815 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.467 ' HB3' HD13 ' A' ' 101' ' ' LEU . 20.9 mtm -136.06 109.95 8.18 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.803 0.841 . . . . 0.0 108.976 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 26.8 m -103.8 132.43 21.05 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 123.647 0.779 . . . . 0.0 110.184 177.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . 0.562 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 49.2 Cg_endo -67.32 141.84 58.0 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.303 2.002 . . . . 0.0 111.137 175.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 86.7 mt . . . . . 0 N--CA 1.47 0.553 0 CA-C-O 121.127 0.489 . . . . 0.0 110.031 -179.841 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 2.3 mp0 . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 32.8 mtp85 -130.86 131.45 44.57 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.622 0.769 . . . . 0.0 110.056 -173.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.5 t -69.46 101.47 1.58 Allowed 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.71 -10.76 55.26 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -169.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 60.8 t -68.73 -51.44 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.54 0.736 . . . . 0.0 110.558 175.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.414 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 1.5 m-70 -89.5 -31.84 17.47 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 -178.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.71 -0.37 67.48 Favored Glycine 0 C--N 1.351 1.416 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.123 -175.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.414 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 10.2 pt-20 -78.55 159.07 28.34 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.915 0.886 . . . . 0.0 111.086 -178.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.527 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 7.9 tpt180 -71.98 132.58 44.49 Favored 'General case' 0 CA--C 1.552 1.02 0 O-C-N 124.011 0.819 . . . . 0.0 109.158 167.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 4.1 pp -101.2 148.62 24.88 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 122.932 0.493 . . . . 0.0 110.17 -177.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.435 ' HA ' HD13 ' A' ' 128' ' ' LEU . 66.5 m80 -144.91 94.88 2.6 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 123.945 0.778 . . . . 0.0 109.096 167.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.552 ' HA ' ' HA ' ' A' ' 127' ' ' PRO . 3.2 tm? -170.43 115.4 0.48 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -95.16 113.17 24.82 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 35.8 t -85.43 112.92 21.31 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -75.87 -32.84 59.89 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.581 0.753 . . . . 0.0 111.612 -174.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 124' ' ' ALA . 21.2 ptmt -74.62 -39.51 62.09 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.711 0.404 . . . . 0.0 111.177 178.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -86.18 -26.59 25.04 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.616 0.766 . . . . 0.0 109.707 -177.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.41 27.19 73.04 Favored Glycine 0 C--N 1.341 0.857 0 C-N-CA 124.126 0.869 . . . . 0.0 113.811 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -131.73 152.99 50.51 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.73 0.812 . . . . 0.0 110.703 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.33 100.24 11.13 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.215 178.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.468 ' HB2' HD11 ' A' ' 101' ' ' LEU . 21.1 mt -89.61 -177.71 5.36 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.761 0.824 . . . . 0.0 109.893 175.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.524 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 1.3 p -112.44 160.72 17.47 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 173.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 47.5 t90 -52.28 -43.3 64.35 Favored 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 124.592 1.157 . . . . 0.0 112.253 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.524 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 95.7 t -59.16 -46.98 91.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 123.55 0.74 . . . . 0.0 111.594 -179.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 71.4 m -79.28 -14.76 58.81 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.668 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.447 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -82.16 -39.52 23.1 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.565 0.746 . . . . 0.0 110.65 177.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -91.83 14.75 14.59 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.205 0.602 . . . . 0.0 110.673 176.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 N--CA 1.473 0.719 0 C-N-CA 123.779 0.832 . . . . 0.0 110.304 169.132 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.401 ' HB2' ' HB3' ' A' ' 105' ' ' LYS . . . . . . . . 0 C--O 1.237 0.408 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.471 ' HB2' HD12 ' A' ' 101' ' ' LEU . 9.3 ptm -167.11 110.94 0.71 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.768 0.827 . . . . 0.0 109.959 -169.314 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.6 m -116.26 136.86 23.12 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.839 1.255 . . . . 0.0 110.063 -178.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . 0.552 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 28.6 Cg_endo -61.31 142.64 96.68 Favored 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.665 2.243 . . . . 0.0 113.124 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' A' ' 100' ' ' HIS . 93.2 mt . . . . . 0 N--CA 1.477 0.909 0 C-N-CA 123.35 0.66 . . . . 0.0 109.503 175.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 . . . . . 0 N--CA 1.482 1.169 0 CA-C-O 120.666 0.27 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.44 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 76.2 mtp180 -124.17 133.88 53.45 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.285 0.634 . . . . 0.0 110.998 -170.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.1 t -67.46 100.41 0.85 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 171.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.45 -13.7 62.27 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -168.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 98.8 t -61.93 -43.98 98.25 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 C-N-CA 123.21 0.604 . . . . 0.0 111.25 173.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -104.37 -38.02 6.99 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 121.508 0.671 . . . . 0.0 109.814 -176.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.79 -3.29 52.69 Favored Glycine 0 CA--C 1.532 1.133 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.616 -172.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.55 157.45 33.87 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 118.159 0.98 . . . . 0.0 109.911 177.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.44 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 36.1 ttp-105 -72.43 124.09 24.45 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 173.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -83.95 134.84 34.64 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.423 0.689 . . . . 0.0 109.584 -177.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -146.41 94.77 2.5 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 168.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.56 HD13 ' SD ' ' A' ' 125' ' ' MET . 2.4 tm? -171.79 153.46 3.32 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 171.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.44 ' N ' HD11 ' A' ' 101' ' ' LEU . 77.1 t80 -143.81 120.06 10.85 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 173.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 44.7 t -82.69 125.64 31.46 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -69.45 -32.4 71.32 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.061 0.944 . . . . 0.0 112.106 -177.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.521 ' HB2' ' HZ3' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -90.95 -41.55 11.07 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.716 0.407 . . . . 0.0 111.459 -178.007 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.445 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 37.0 t70 -78.85 -28.43 44.27 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.257 0.623 . . . . 0.0 110.723 -177.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.54 35.85 62.71 Favored Glycine 0 C--N 1.351 1.392 0 CA-C-N 116.027 -0.533 . . . . 0.0 114.22 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -133.67 147.09 51.39 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.328 0.651 . . . . 0.0 111.58 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.96 100.51 9.72 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.516 176.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 77.4 mt -100.62 -175.79 3.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.173 0.989 . . . . 0.0 111.008 -176.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.425 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 10.1 p -110.68 170.84 7.82 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 168.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 82.9 t90 -57.24 -47.01 82.44 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.807 0.443 . . . . 0.0 111.653 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.425 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 71.1 t -55.28 -47.61 77.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 C-N-CA 123.916 0.886 . . . . 0.0 112.387 -175.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 74.4 m -76.68 -19.72 57.42 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.548 0.339 . . . . 0.0 111.554 -178.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.21 -34.37 32.28 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.42 0.629 . . . . 0.0 110.567 177.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -114.45 17.56 17.33 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.252 -170.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 38.7 t . . . . . 0 C--O 1.244 0.774 0 C-N-CA 123.408 0.683 . . . . 0.0 110.302 175.536 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.004 0 CA-C-O 121.399 0.619 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.56 ' SD ' HD13 ' A' ' 101' ' ' LEU . 7.0 mmt -121.05 119.78 33.46 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.099 1.36 . . . . 0.0 108.374 177.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 36.0 m -117.7 145.71 37.08 Favored Pre-proline 0 N--CA 1.488 1.451 0 C-N-CA 123.703 0.801 . . . . 0.0 110.826 -176.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -70.66 151.63 64.07 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.869 2.379 . . . . 0.0 113.377 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 87.3 mt . . . . . 0 N--CA 1.468 0.448 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 168.653 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.519 ' HG3' ' HG3' ' A' ' 91' ' ' ARG . 6.3 pt-20 . . . . . 0 N--CA 1.481 1.098 0 CA-C-O 120.891 0.377 . . . . 0.0 111.305 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.519 ' HG3' ' HG3' ' A' ' 90' ' ' GLU . 60.9 mtt85 -118.96 136.09 54.26 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.476 1.111 . . . . 0.0 108.763 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 8.8 t -69.71 102.0 1.8 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 173.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.73 -20.03 63.06 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -170.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.3 t -62.53 -40.34 87.85 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.299 0 C-N-CA 123.973 0.909 . . . . 0.0 111.651 177.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.484 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.3 m-70 -107.59 -38.23 5.96 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.16 0.505 . . . . 0.0 110.095 -177.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.31 25.65 15.85 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.457 -0.792 . . . . 0.0 113.2 -176.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.484 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.0 OUTLIER -113.36 152.49 29.9 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.608 0.763 . . . . 0.0 109.535 174.13 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -70.21 122.94 20.45 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.315 0.646 . . . . 0.0 109.688 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.6 pp -80.97 138.61 36.08 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.985 -171.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -144.79 98.12 3.13 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.547 0.739 . . . . 0.0 109.78 167.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.676 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 1.9 tm? -168.28 143.09 3.48 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 105.243 -2.132 . . . . 0.0 105.243 169.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -129.69 115.23 17.03 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . 0.413 ' SG ' ' HG2' ' A' ' 105' ' ' LYS . 47.5 t -97.02 131.97 43.3 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.378 0.671 . . . . 0.0 109.386 179.018 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -74.3 -52.21 12.94 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.004 0.922 . . . . 0.0 111.121 -178.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.413 ' HG2' ' SG ' ' A' ' 103' ' ' CYS . 14.8 ptmm? -63.07 -38.66 92.07 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.042 0.537 . . . . 0.0 111.06 -176.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -83.66 -29.66 27.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.7 0.8 . . . . 0.0 109.857 -178.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.19 34.71 88.97 Favored Glycine 0 C--N 1.346 1.131 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.518 179.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -132.7 147.35 52.33 Favored 'General case' 0 C--O 1.242 0.67 0 C-N-CA 123.44 0.696 . . . . 0.0 110.738 -172.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.23 99.99 10.91 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 114.333 -1.303 . . . . 0.0 108.341 172.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 59.8 mt -93.9 -177.3 4.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.023 0.929 . . . . 0.0 110.242 179.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.506 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 2.8 p -108.9 159.68 16.61 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 173.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -58.85 -33.92 71.0 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.281 0.632 . . . . 0.0 111.765 177.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.506 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 28.6 t -63.69 -43.47 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.312 0 C-N-CA 123.622 0.769 . . . . 0.0 111.021 -179.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 91.5 m -77.73 -17.91 57.09 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 122.936 0.494 . . . . 0.0 111.186 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.676 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -73.52 -40.65 63.87 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 122.844 0.458 . . . . 0.0 110.304 170.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -87.19 -9.94 53.9 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.524 0.73 . . . . 0.0 112.369 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 80.4 p . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 168.813 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.938 0 CA-C-O 121.462 0.649 . . . . 0.0 111.321 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 84.0 mtp -122.24 109.1 14.05 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.5 m -108.03 162.71 18.91 Favored Pre-proline 0 N--CA 1.48 1.05 0 C-N-CA 124.488 1.115 . . . . 0.0 109.303 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -66.82 150.35 83.28 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 121.787 1.658 . . . . 0.0 110.877 171.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.457 ' HB2' ' N ' ' A' ' 101' ' ' LEU . 1.7 tt . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 59.2 mtm-85 -115.34 135.0 54.59 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.843 1.257 . . . . 0.0 108.796 174.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.4 ' HB3' ' OE2' ' A' ' 97' ' ' GLU . 10.3 t -69.42 102.07 1.7 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 176.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -50.66 -30.13 12.82 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.842 1.257 . . . . 0.0 113.906 -172.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.71 -42.87 96.23 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.071 0 C-N-CA 123.421 0.689 . . . . 0.0 112.002 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.9 -37.79 8.09 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 120.997 0.427 . . . . 0.0 110.21 -175.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.91 3.88 54.64 Favored Glycine 0 C--N 1.346 1.108 0 CA-C-N 115.472 -0.786 . . . . 0.0 113.844 178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.4 ' OE2' ' HB3' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -94.79 166.46 11.97 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-N 117.765 0.782 . . . . 0.0 109.882 177.376 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -73.09 120.91 19.38 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.039 0.535 . . . . 0.0 110.142 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -80.17 136.99 36.61 Favored 'General case' 0 C--N 1.349 0.551 0 C-N-CA 123.711 0.804 . . . . 0.0 109.587 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -145.0 95.01 2.62 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 166.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.48 ' HG ' ' HB3' ' A' ' 115' ' ' ALA . 2.6 tm? -172.16 149.3 2.29 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 168.117 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.454 ' HB2' HD22 ' A' ' 128' ' ' LEU . 79.0 t80 -130.5 114.23 15.24 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 172.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 41.1 t -84.22 120.15 25.87 Favored 'General case' 0 C--O 1.227 -0.103 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 177.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -70.87 -39.59 72.79 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.613 0.765 . . . . 0.0 111.152 -172.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.563 ' HB2' ' HZ2' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -76.44 -34.47 58.76 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.224 -178.369 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.544 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 32.6 t70 -84.93 -26.62 27.11 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.011 0.924 . . . . 0.0 110.318 -179.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.65 13.96 69.27 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-N 114.373 -1.285 . . . . 0.0 114.81 176.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -113.98 150.02 34.46 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-N 117.415 0.607 . . . . 0.0 110.45 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.21 101.32 7.03 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.697 -1.138 . . . . 0.0 108.697 174.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 75.7 mt -94.92 -177.28 4.11 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.813 0.845 . . . . 0.0 110.58 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.614 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 9.7 p -111.81 168.25 9.73 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 173.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 26.4 t90 -65.04 -32.14 73.72 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 122.745 0.418 . . . . 0.0 111.197 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.614 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 44.2 t -59.43 -46.36 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 C-N-CA 123.681 0.792 . . . . 0.0 110.909 177.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 83.2 m -79.41 -19.2 50.6 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.895 0.478 . . . . 0.0 111.348 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.48 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -71.36 -49.44 42.26 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.188 0.595 . . . . 0.0 110.618 177.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -77.31 -18.42 57.51 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.28 0.632 . . . . 0.0 111.187 177.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 35.8 t . . . . . 0 C--N 1.355 0.826 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 173.304 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.467 0 CA-C-O 121.107 0.48 . . . . 0.0 109.964 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 17.9 ptp -161.85 142.27 10.47 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.184 0.994 . . . . 0.0 109.949 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 17.4 m -127.96 150.17 72.85 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.039 1.336 . . . . 0.0 109.868 179.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -74.32 140.81 27.97 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 122.504 2.136 . . . . 0.0 112.383 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.454 HD22 ' HB2' ' A' ' 102' ' ' PHE . 74.8 mt . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 N--CA 1.47 0.53 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -129.34 135.27 48.52 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.75 0.42 . . . . 0.0 111.597 -172.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.9 t -73.16 102.05 3.49 Favored 'General case' 0 C--N 1.349 0.586 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 174.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.31 -20.26 62.72 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.165 0.986 . . . . 0.0 113.135 -174.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 16.0 t -67.09 -40.8 86.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 123.527 0.731 . . . . 0.0 111.252 -178.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . 0.51 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 2.4 m-70 -103.49 -38.78 7.02 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 121.051 0.453 . . . . 0.0 109.951 -176.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.1 56.32 1.84 Allowed Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.162 -172.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.51 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 5.8 pt-20 -142.09 161.09 38.88 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.786 1.235 . . . . 0.0 109.531 -178.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -72.68 140.56 47.96 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 pp -114.08 140.21 48.67 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.35 0.66 . . . . 0.0 110.234 -177.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -142.37 95.27 2.77 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 164.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.502 HD11 ' SD ' ' A' ' 125' ' ' MET . 2.5 tm? -169.11 148.28 4.0 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.326 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -132.94 119.11 19.72 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.9 t -79.13 108.26 12.5 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 172.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.524 ' HB2' ' HB2' ' A' ' 124' ' ' ALA . 29.5 mt-10 -75.75 -34.82 60.31 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.66 0.384 . . . . 0.0 110.423 -178.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -69.47 -22.82 63.6 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.843 -178.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -111.22 -30.78 7.31 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.61 0.764 . . . . 0.0 110.673 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.48 48.35 10.82 Favored Glycine 0 C--N 1.336 0.539 0 CA-C-N 115.328 -0.851 . . . . 0.0 113.86 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -141.45 146.52 36.61 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.558 0.743 . . . . 0.0 110.857 175.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.427 ' HB1' HD11 ' A' ' 128' ' ' LEU . . . -81.18 107.3 13.85 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.847 0.859 . . . . 0.0 110.83 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.414 ' HB2' HD13 ' A' ' 101' ' ' LEU . 94.0 mt -102.54 -176.26 3.05 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.825 0.85 . . . . 0.0 110.591 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.591 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 4.5 p -108.5 159.23 16.86 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 172.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 62.6 t90 -52.38 -39.56 60.99 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.435 0.694 . . . . 0.0 111.937 175.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.591 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 48.2 t -57.91 -52.1 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 123.139 0.576 . . . . 0.0 111.509 179.063 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 88.9 m -72.92 -19.01 61.34 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 122.568 0.347 . . . . 0.0 111.655 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.404 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -72.19 -57.34 4.32 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 122.841 0.456 . . . . 0.0 110.386 176.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 21.3 mm-40 -74.37 -30.1 61.84 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.46 -173.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 30.8 t . . . . . 0 N--CA 1.469 0.512 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 168.039 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.524 ' HB2' ' HB2' ' A' ' 104' ' ' GLU . . . . . . . . 0 C--O 1.241 0.624 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.502 ' SD ' HD11 ' A' ' 101' ' ' LEU . 5.7 mmt -137.51 121.3 17.52 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.067 0.947 . . . . 0.0 109.472 -175.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.01 141.36 41.51 Favored Pre-proline 0 N--CA 1.489 1.508 0 C-N-CA 123.562 0.745 . . . . 0.0 109.955 176.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -70.23 150.81 65.88 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.457 2.105 . . . . 0.0 112.008 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.427 HD11 ' HB1' ' A' ' 109' ' ' ALA . 95.9 mt . . . . . 0 N--CA 1.475 0.776 0 CA-C-O 121.156 0.503 . . . . 0.0 109.772 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.473 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 11.1 p -73.7 90.04 1.81 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.202 1.001 . . . . 0.0 110.789 -174.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -64.62 101.97 0.52 Allowed 'General case' 0 C--N 1.354 0.776 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 124.42 104.82 1.6 Allowed Glycine 0 C--N 1.343 0.939 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 -173.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.427 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 38.9 mt-10 -86.43 99.51 11.69 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.516 0.726 . . . . 0.0 109.372 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -87.99 155.82 19.63 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.925 0.89 . . . . 0.0 110.224 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.55 100.63 3.94 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 170.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.49 -28.23 66.83 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.934 0.894 . . . . 0.0 112.371 -170.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 86.0 t -59.26 -43.37 89.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 123.565 0.746 . . . . 0.0 111.515 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -98.01 -37.81 9.62 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 121.125 0.488 . . . . 0.0 110.443 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.56 49.45 2.75 Favored Glycine 0 C--N 1.343 0.921 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.265 -174.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -138.48 161.64 36.51 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.338 0.655 . . . . 0.0 110.651 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -68.04 137.42 55.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.067 0.947 . . . . 0.0 109.159 170.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 3.3 pp -111.33 138.34 47.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.629 0.372 . . . . 0.0 110.991 -176.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.468 ' HA ' HD12 ' A' ' 128' ' ' LEU . 76.8 m-70 -141.11 96.61 3.03 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.586 0.754 . . . . 0.0 109.169 167.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.649 ' HA ' ' HA ' ' A' ' 127' ' ' PRO . 3.1 tm? -170.28 141.39 2.03 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 170.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -125.9 111.51 14.89 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 174.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . 0.482 ' SG ' ' SD ' ' A' ' 125' ' ' MET . 75.0 m -73.72 112.31 9.7 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 168.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -74.13 -37.7 64.01 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 13.5 ptmm? -63.08 -46.98 84.85 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.859 177.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.534 ' HB3' ' HD3' ' A' ' 108' ' ' LYS . 6.9 m-20 -84.61 -28.98 26.13 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.33 0.652 . . . . 0.0 110.648 178.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.57 43.74 91.5 Favored Glycine 0 C--N 1.343 0.953 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.447 -172.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.534 ' HD3' ' HB3' ' A' ' 106' ' ' ASP . 58.4 mtpt -134.33 157.62 45.9 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.818 1.247 . . . . 0.0 109.865 -174.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -103.08 107.9 18.87 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.205 0.602 . . . . 0.0 110.047 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.435 ' HB2' HD13 ' A' ' 101' ' ' LEU . 68.8 mt -107.81 -175.55 2.81 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.896 0.878 . . . . 0.0 110.329 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.459 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 19.6 p -110.43 176.67 4.95 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.015 0.526 . . . . 0.0 110.117 173.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . 0.455 ' O ' ' HG2' ' A' ' 116' ' ' GLN . 51.7 t90 -56.99 -42.4 80.21 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.916 0.76 . . . . 0.0 110.87 173.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.459 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 43.8 t -61.05 -36.45 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 123.558 0.743 . . . . 0.0 111.461 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.433 ' HB2' ' HB3' ' A' ' 110' ' ' LEU . 89.5 m -78.14 -21.82 49.71 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.863 176.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.568 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -72.77 -34.92 67.28 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 170.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 112' ' ' TRP . 12.9 mm100 -79.55 -7.47 58.51 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.325 1.05 . . . . 0.0 111.451 177.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t -64.77 134.4 54.07 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 123.237 0.615 . . . . 0.0 110.839 -178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 11.3 ptp85 -66.61 -17.14 64.67 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.09 0.956 . . . . 0.0 110.965 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -68.1 -61.07 2.03 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.175 0.99 . . . . 0.0 111.505 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -81.57 111.94 18.34 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.55 -162.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -65.1 103.19 0.72 Allowed 'General case' 0 C--N 1.353 0.727 0 C-N-CA 123.939 0.896 . . . . 0.0 110.927 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -64.78 117.33 7.35 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 124.477 1.111 . . . . 0.0 111.205 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 -159.15 -81.2 0.05 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 174.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.454 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . -93.25 72.97 4.58 Favored 'General case' 0 C--N 1.35 0.611 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.482 ' SD ' ' SG ' ' A' ' 103' ' ' CYS . 23.7 mtm -144.2 119.01 9.88 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.2 m -121.49 137.71 27.33 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 123.929 0.892 . . . . 0.0 109.44 175.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . 0.649 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 32.5 Cg_endo -61.9 155.26 56.01 Favored 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.425 2.083 . . . . 0.0 112.993 177.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 100' ' ' HIS . 96.7 mt -75.28 93.24 2.84 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.404 0.682 . . . . 0.0 110.276 -177.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -97.78 22.79 8.67 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.985 0.914 . . . . 0.0 112.052 -170.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 . . . . . 0 CA--C 1.546 0.821 0 C-N-CA 123.533 0.733 . . . . 0.0 109.219 -178.251 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.302 0 N-CA-C 113.865 0.306 . . . . 0.0 113.865 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.1 t -146.94 139.22 24.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.366 1.066 . . . . 0.0 108.368 175.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -142.13 12.66 2.01 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.3 1.04 . . . . 0.0 110.423 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -58.88 129.37 49.55 Favored Glycine 0 C--N 1.353 1.481 0 CA-C-O 119.446 -0.641 . . . . 0.0 111.84 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -69.68 93.51 0.72 Allowed 'General case' 0 C--N 1.35 0.619 0 CA-C-O 121.806 0.812 . . . . 0.0 110.586 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -107.79 153.16 23.38 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 113.85 -1.523 . . . . 0.0 109.206 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.8 t -61.82 102.36 0.26 Allowed 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.4 -19.66 64.87 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.291 1.036 . . . . 0.0 113.228 -170.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 19.6 t -66.79 -40.8 86.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.443 0.697 . . . . 0.0 111.124 -178.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.434 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.5 m-70 -104.12 -38.22 7.01 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -177.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.35 37.08 5.2 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-N 114.802 -1.09 . . . . 0.0 112.356 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 1.6 pp20? -132.38 153.76 50.46 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.593 0.757 . . . . 0.0 109.969 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -66.1 133.31 50.46 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.692 0.797 . . . . 0.0 111.101 -173.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.5 pp -98.97 146.38 26.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.499 0.72 . . . . 0.0 110.041 -174.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -145.96 93.27 2.31 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 164.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.505 HD13 ' HB2' ' A' ' 110' ' ' LEU . 2.7 tm? -171.42 138.84 1.21 Allowed 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 173.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -125.84 115.91 20.72 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . 0.619 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 30.5 t -84.54 127.05 33.83 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -71.87 -45.54 60.96 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.779 0.832 . . . . 0.0 110.985 -175.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -69.61 -32.06 70.56 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.042 0.537 . . . . 0.0 111.273 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.619 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 29.4 t70 -94.08 -27.42 16.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.249 1.019 . . . . 0.0 110.818 -171.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.33 34.42 89.87 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-N 115.421 -0.809 . . . . 0.0 113.643 178.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -140.09 162.21 35.77 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.174 0.99 . . . . 0.0 110.084 -175.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -95.96 102.4 14.19 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.747 0.819 . . . . 0.0 110.808 -175.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.505 ' HB2' HD13 ' A' ' 101' ' ' LEU . 74.3 mt -91.54 -176.65 4.57 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.217 1.007 . . . . 0.0 110.499 176.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.4 p -116.29 172.94 6.87 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.15 0.58 . . . . 0.0 110.212 174.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 23.3 t90 -59.41 -47.04 86.98 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.906 0.882 . . . . 0.0 111.781 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 39.8 t -57.86 -39.89 73.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 123.561 0.538 . . . . 0.0 110.821 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 99.0 m -79.28 -26.84 42.29 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.106 0.562 . . . . 0.0 111.632 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.501 ' HB1' ' HG ' ' A' ' 101' ' ' LEU . . . -68.02 -37.09 80.99 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.043 0.537 . . . . 0.0 111.118 177.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -106.42 9.16 31.81 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.18 0.592 . . . . 0.0 111.584 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 44.0 t -59.98 143.48 51.62 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.057 0.543 . . . . 0.0 110.248 179.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -66.43 -7.09 17.14 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.431 0.692 . . . . 0.0 112.328 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -74.02 -35.5 64.37 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.348 0.659 . . . . 0.0 111.147 175.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -141.65 -170.73 3.17 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.099 0.96 . . . . 0.0 110.347 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -139.94 -179.94 6.25 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.737 0.815 . . . . 0.0 109.23 171.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.731 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 9.4 p-10 -90.81 128.67 36.8 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.381 0.673 . . . . 0.0 110.034 176.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 -152.71 -81.41 0.09 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.847 0.859 . . . . 0.0 109.324 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -86.51 74.74 9.85 Favored 'General case' 0 C--N 1.353 0.738 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 177.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.731 ' SD ' ' HA ' ' A' ' 122' ' ' ASP . 2.0 ptm -169.78 129.66 0.99 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.017 -175.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.4 m -107.25 149.99 39.4 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 124.724 1.21 . . . . 0.0 109.412 174.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -76.24 140.52 22.24 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 122.432 2.088 . . . . 0.0 112.55 176.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 73.4 mt -79.14 91.97 5.0 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 173.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -105.88 79.31 1.41 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 175.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 . . . . . 0 CA--C 1.549 0.938 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.99 -174.239 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.587 0 N-CA-C 109.79 -1.324 . . . . 0.0 109.79 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.7 p -99.6 -154.45 0.47 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.486 1.114 . . . . 0.0 109.01 171.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.53 18.22 3.43 Favored 'General case' 0 CA--C 1.563 1.476 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 170.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 63.92 43.81 96.96 Favored Glycine 0 C--N 1.354 1.577 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -169.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -66.92 109.45 2.95 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 124.694 1.198 . . . . 0.0 111.444 -168.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.466 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 85.0 mtt85 -120.37 151.05 39.8 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 114.271 -1.332 . . . . 0.0 110.198 -175.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -65.69 101.66 0.65 Allowed 'General case' 0 C--N 1.348 0.54 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.06 -29.12 67.08 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.821 0.848 . . . . 0.0 112.984 -171.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 47.4 t -57.14 -42.5 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 123.816 0.847 . . . . 0.0 111.756 -177.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -104.68 -35.07 7.93 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 -176.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.07 -3.3 55.37 Favored Glycine 0 N--CA 1.476 1.303 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.387 -175.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -83.44 164.31 19.99 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.077 0.951 . . . . 0.0 111.071 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.466 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 41.3 ttp180 -64.5 150.95 45.65 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.065 0.946 . . . . 0.0 110.429 173.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -117.37 141.37 48.4 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.829 0.452 . . . . 0.0 110.275 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 15.9 m80 -149.24 93.83 2.14 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 166.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' A' ' 110' ' ' LEU . 3.0 tm? -170.43 143.67 2.33 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 170.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -131.2 104.38 7.03 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 176.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 42.0 t -86.03 118.84 25.75 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -76.55 -39.68 52.08 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.225 0.61 . . . . 0.0 111.407 -174.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.423 ' HD3' ' HA ' ' A' ' 122' ' ' ASP . 0.0 OUTLIER -67.16 -38.65 85.82 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.926 0.491 . . . . 0.0 111.34 177.752 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -81.51 -29.15 33.71 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.184 0.594 . . . . 0.0 110.129 177.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.2 36.1 92.44 Favored Glycine 0 C--N 1.343 0.96 0 CA-C-N 114.815 -1.084 . . . . 0.0 113.398 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -132.22 145.72 51.52 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 124.212 1.005 . . . . 0.0 109.903 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.72 99.74 9.1 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 171.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.512 ' HB2' HD11 ' A' ' 101' ' ' LEU . 83.9 mt -94.76 -176.75 3.97 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.855 0.862 . . . . 0.0 110.533 -178.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.497 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 7.0 p -113.54 164.49 13.57 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 172.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -59.42 -36.21 75.43 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.708 0.803 . . . . 0.0 111.702 178.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.497 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 84.6 t -60.43 -46.03 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 123.233 0.613 . . . . 0.0 111.135 178.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.6 m -78.63 -18.11 54.98 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.692 0.397 . . . . 0.0 111.253 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.33 -41.08 57.6 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.282 0.633 . . . . 0.0 110.201 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -78.76 -17.28 56.05 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.619 0.768 . . . . 0.0 110.803 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.5 t -68.22 113.74 6.11 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -75.2 76.03 2.34 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 122.174 0.987 . . . . 0.0 109.725 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -74.31 -56.92 4.32 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 114.614 -1.176 . . . . 0.0 109.953 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -138.37 -80.2 0.34 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 177.69 121.23 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.318 1.047 . . . . 0.0 108.949 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 33.3 t70 -88.44 152.69 21.72 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.169 0.509 . . . . 0.0 110.392 175.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 48.6 m80 -133.92 -12.81 2.54 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.745 1.218 . . . . 0.0 110.065 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -168.57 99.17 0.41 Allowed 'General case' 0 C--N 1.361 1.101 0 C-N-CA 123.792 0.837 . . . . 0.0 110.387 -176.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 15.4 ptp -132.74 124.41 28.07 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.425 0.69 . . . . 0.0 109.148 167.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.3 m -104.33 136.85 19.12 Favored Pre-proline 0 CA--C 1.552 1.058 0 C-N-CA 123.731 0.813 . . . . 0.0 109.698 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.27 129.86 16.64 Favored 'Trans proline' 0 C--N 1.372 1.787 0 C-N-CA 122.596 2.197 . . . . 0.0 112.206 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 88.7 mt -78.2 121.61 24.59 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -136.95 136.79 38.88 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.053 0.941 . . . . 0.0 108.53 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 . . . . . 0 CA--C 1.553 1.073 0 C-N-CA 123.011 0.525 . . . . 0.0 109.605 -179.927 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.482 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 45.0 p -107.23 113.21 26.48 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.327 0.651 . . . . 0.0 110.569 -177.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -107.22 7.67 29.54 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.885 0.874 . . . . 0.0 110.613 175.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.14 175.31 49.89 Favored Glycine 0 C--N 1.347 1.161 0 O-C-N 123.156 0.285 . . . . 0.0 112.518 -176.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -79.38 74.87 5.99 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.488 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 82.7 mtp180 -125.61 132.87 52.42 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.849 -175.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -65.89 100.48 0.57 Allowed 'General case' 0 C--N 1.355 0.841 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 176.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.53 -24.61 63.82 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.784 0.834 . . . . 0.0 112.475 -173.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.09 -39.98 87.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 124.268 1.027 . . . . 0.0 111.789 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.481 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 1.9 m-70 -105.51 -31.86 8.78 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.18 -10.66 58.36 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-N 115.12 -0.945 . . . . 0.0 112.539 -175.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.481 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 9.4 pt-20 -73.62 179.34 4.18 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-N 117.429 0.615 . . . . 0.0 110.31 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.488 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 33.5 mtp-105 -69.54 -178.98 1.56 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.689 0.795 . . . . 0.0 111.899 172.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 pp -150.93 145.35 25.55 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.977 173.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 12.7 m170 -152.84 92.95 1.7 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 164.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.53 HD13 ' HB2' ' A' ' 110' ' ' LEU . 2.6 tm? -170.45 146.76 2.87 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.433 ' N ' HD12 ' A' ' 101' ' ' LEU . 60.2 t80 -140.36 108.53 5.77 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . 0.657 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 43.6 t -79.77 143.02 34.83 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -76.97 -39.98 48.57 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.281 0.632 . . . . 0.0 111.638 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -79.55 -46.42 17.37 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.436 0.294 . . . . 0.0 111.392 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.657 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 32.1 t70 -66.16 -31.74 72.77 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.173 0.589 . . . . 0.0 109.916 178.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.28 16.18 62.17 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.044 -0.98 . . . . 0.0 114.39 173.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -128.22 168.5 15.37 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.744 0.818 . . . . 0.0 109.257 -178.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -83.64 104.44 13.76 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.957 -1.019 . . . . 0.0 110.474 -177.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.53 ' HB2' HD13 ' A' ' 101' ' ' LEU . 82.9 mt -91.22 -179.01 5.31 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.7 0.8 . . . . 0.0 110.656 174.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.556 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 8.8 p -117.92 162.77 17.59 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 171.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -59.9 -33.89 72.45 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.72 0.808 . . . . 0.0 112.112 178.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.556 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 57.7 t -58.91 -44.0 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 C-N-CA 123.36 0.664 . . . . 0.0 110.786 175.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.457 ' HB3' ' NE2' ' A' ' 120' ' ' HIS . 74.0 m -74.46 -29.06 61.31 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.465 0.706 . . . . 0.0 111.018 177.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.417 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -67.51 -35.21 78.68 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.965 0.506 . . . . 0.0 111.241 178.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -78.03 -26.96 48.71 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.406 0.682 . . . . 0.0 111.111 177.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.9 t -61.48 117.54 5.85 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 123.286 0.634 . . . . 0.0 110.934 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.686 ' HA ' ' HB2' ' A' ' 121' ' ' ARG . 97.2 mtt180 -65.38 -16.82 64.0 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.792 0.837 . . . . 0.0 111.794 178.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -49.04 -49.15 42.62 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.755 1.222 . . . . 0.0 111.442 173.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.457 ' NE2' ' HB3' ' A' ' 114' ' ' CYS . 15.2 p-80 -134.8 50.49 2.16 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-O 122.054 0.93 . . . . 0.0 109.018 177.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.686 ' HB2' ' HA ' ' A' ' 118' ' ' ARG . 36.6 ttt180 -60.7 122.5 14.91 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.401 177.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -146.52 149.24 33.23 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.232 0.539 . . . . 0.0 110.478 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -103.77 -25.32 13.15 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.162 1.385 . . . . 0.0 109.492 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -80.38 72.08 7.23 Favored 'General case' 0 C--N 1.354 0.769 0 CA-C-O 121.933 0.873 . . . . 0.0 109.586 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.1 ptp -148.23 156.47 42.6 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.096 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 31.4 m -125.9 147.07 57.62 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 124.644 1.177 . . . . 0.0 109.67 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.7 128.71 10.35 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 122.203 1.936 . . . . 0.0 112.069 174.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 57.6 mt -76.93 95.02 4.03 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 174.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -164.88 105.87 0.81 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 . . . . . 0 N--CA 1.478 0.954 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 -178.928 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.425 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.4 t -157.0 136.38 12.1 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 123.896 0.878 . . . . 0.0 109.146 173.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -79.1 -75.02 0.26 Allowed 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 177.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 125.5 150.13 7.65 Favored Glycine 0 C--N 1.343 0.95 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 -175.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -89.55 90.93 8.48 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.895 0.878 . . . . 0.0 109.8 -177.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.427 ' HG3' ' HA ' ' A' ' 98' ' ' ARG . 0.0 OUTLIER -122.83 138.34 54.67 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.46 0.704 . . . . 0.0 111.078 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.8 t -67.5 101.35 0.97 Allowed 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 169.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.08 -14.59 60.86 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -167.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 77.9 t -68.34 -46.03 81.48 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 123.059 0.544 . . . . 0.0 111.032 175.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -99.42 -39.54 8.32 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.005 0.431 . . . . 0.0 110.664 -174.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.62 2.52 53.08 Favored Glycine 0 CA--C 1.534 1.25 0 CA-C-N 115.4 -0.818 . . . . 0.0 113.16 -172.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -82.05 152.49 26.6 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 117.307 0.554 . . . . 0.0 109.702 177.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.427 ' HA ' ' HG3' ' A' ' 91' ' ' ARG . 54.1 ttp180 -70.09 119.71 14.69 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 123.561 0.744 . . . . 0.0 109.13 174.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -76.49 136.46 39.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -177.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.3 m80 -154.0 93.82 1.68 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.804 0.841 . . . . 0.0 109.234 172.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.496 HD12 ' HE2' ' A' ' 125' ' ' MET . 3.1 tm? -171.44 150.03 2.79 Favored 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 170.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.459 ' N ' HD13 ' A' ' 101' ' ' LEU . 61.2 t80 -138.68 110.94 7.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 48.6 t -84.19 139.64 32.26 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -73.33 -53.65 10.28 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 122.723 0.409 . . . . 0.0 110.665 -174.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.565 ' HB3' ' HZ1' ' A' ' 105' ' ' LYS . 0.4 OUTLIER -63.97 -34.88 78.99 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.454 0.702 . . . . 0.0 112.513 -179.231 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.456 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 30.3 t0 -82.83 -33.02 27.26 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 -177.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.36 25.71 67.1 Favored Glycine 0 C--N 1.351 1.397 0 CA-C-N 115.349 -0.842 . . . . 0.0 113.631 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -120.25 150.3 40.9 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.132 0.973 . . . . 0.0 109.901 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.26 100.52 11.27 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.149 176.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 28.4 mt -90.93 -178.24 5.16 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.344 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.6 p -112.76 178.08 4.41 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 46.8 t90 -63.41 -51.11 67.17 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.401 0.438 . . . . 0.0 111.872 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 97.5 t -61.7 -45.89 97.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 C-N-CA 123.287 0.635 . . . . 0.0 112.175 -174.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 96.7 m -68.99 -25.3 64.45 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 122.738 0.415 . . . . 0.0 111.838 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.96 -51.74 6.9 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 123.113 0.565 . . . . 0.0 111.227 -175.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -81.3 -10.85 59.49 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.734 -172.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 33.5 t -74.77 94.93 2.81 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 161.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -65.77 103.93 0.98 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.971 0.908 . . . . 0.0 112.114 -164.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -122.94 -158.59 0.8 Allowed 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.923 1.289 . . . . 0.0 108.461 172.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 9.5 p-80 -73.56 55.57 0.5 Allowed 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 124.918 1.287 . . . . 0.0 112.114 176.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 81.7 mmt-85 -144.9 -36.73 0.3 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.368 1.467 . . . . 0.0 108.478 -178.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.639 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 16.3 t70 -74.19 82.31 1.82 Allowed 'General case' 0 C--N 1.356 0.88 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.348 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -146.28 -65.91 0.29 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -132.09 117.58 18.52 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 174.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.639 ' SD ' ' HA ' ' A' ' 122' ' ' ASP . 15.4 ptm -163.29 117.62 1.63 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.794 0.838 . . . . 0.0 109.409 -170.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 30.2 m -92.05 135.36 27.28 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 122.955 0.502 . . . . 0.0 109.995 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.26 120.65 6.07 Favored 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 122.26 1.974 . . . . 0.0 111.671 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 98.7 mt -70.27 115.87 9.97 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 169.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -125.74 98.81 5.71 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -176.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 . . . . . 0 CA--C 1.548 0.876 0 N-CA-C 108.831 -0.804 . . . . 0.0 108.831 179.557 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.582 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.445 ' HB ' ' HB2' ' A' ' 91' ' ' ARG . 66.6 p -68.58 103.56 1.73 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.413 0.685 . . . . 0.0 109.576 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -70.23 104.17 2.57 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.541 0.736 . . . . 0.0 110.615 -171.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.01 173.7 22.68 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.555 -172.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.67 90.96 0.78 Allowed 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.567 ' HG2' ' HD2' ' A' ' 98' ' ' ARG . 69.4 mtt180 -127.69 136.44 51.58 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.913 0.885 . . . . 0.0 109.922 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.1 t -72.71 100.41 2.82 Favored 'General case' 0 C--N 1.354 0.792 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 175.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.78 -30.12 71.25 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.877 0.871 . . . . 0.0 111.861 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 67.8 t -52.46 -40.5 32.82 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 124.961 1.305 . . . . 0.0 112.314 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -103.99 -37.84 7.21 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.46 24.33 18.94 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 114.953 -1.022 . . . . 0.0 111.815 -171.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -103.33 178.72 4.47 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.567 ' HD2' ' HG2' ' A' ' 91' ' ' ARG . 4.7 tpt180 -74.93 166.26 23.94 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 123.759 0.824 . . . . 0.0 109.953 173.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.5 pp -133.6 134.7 43.59 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.526 -0.734 . . . . 0.0 110.594 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.594 ' HA ' HD13 ' A' ' 128' ' ' LEU . 78.7 m-70 -142.17 95.45 2.8 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 166.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.549 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -171.95 154.81 3.61 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 170.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -135.4 116.09 13.9 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 28.8 t -85.65 124.18 31.9 Favored 'General case' 0 C--N 1.346 0.416 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -73.71 -44.93 55.08 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.408 0.683 . . . . 0.0 110.969 -173.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.408 ' HB3' ' HZ1' ' A' ' 105' ' ' LYS . 0.2 OUTLIER -75.3 -40.65 58.35 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.644 -178.593 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -78.2 -31.91 49.69 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.253 0.621 . . . . 0.0 110.067 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.18 -19.61 25.82 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.619 -0.719 . . . . 0.0 114.538 174.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -88.24 144.13 26.62 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 117.712 0.756 . . . . 0.0 111.45 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.418 ' HB2' HD11 ' A' ' 128' ' ' LEU . . . -73.4 114.81 12.03 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.738 174.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.486 ' HB2' HD12 ' A' ' 101' ' ' LEU . 82.9 mt -98.93 179.19 4.71 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.74 0.816 . . . . 0.0 110.706 -178.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 8.2 p -99.61 164.1 12.21 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 168.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 63.1 t90 -62.62 -36.01 81.41 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 123.42 0.45 . . . . 0.0 111.325 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 85.0 t -59.77 -40.56 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 C-N-CA 123.256 0.623 . . . . 0.0 111.357 176.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 66.8 m -74.68 -20.81 59.72 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.793 0.437 . . . . 0.0 111.157 177.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.549 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -74.85 -44.0 51.46 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.269 0.628 . . . . 0.0 110.968 176.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -96.24 5.71 50.42 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.983 0.913 . . . . 0.0 111.759 -176.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t -58.24 135.92 57.21 Favored 'General case' 0 C--O 1.245 0.84 0 C-N-CA 123.682 0.793 . . . . 0.0 110.99 -176.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -71.9 87.78 1.02 Allowed 'General case' 0 CA--C 1.543 0.708 0 O-C-N 123.995 0.809 . . . . 0.0 109.052 -177.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -152.08 -55.4 0.13 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.02 1.328 . . . . 0.0 108.059 -170.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -164.63 164.4 21.51 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.173 -1.376 . . . . 0.0 109.253 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -73.18 153.12 40.83 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.288 0.635 . . . . 0.0 110.126 177.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -62.84 125.95 25.68 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 175.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -99.08 -60.32 1.56 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -174.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -145.08 100.98 3.56 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 124.166 0.986 . . . . 0.0 108.915 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 17.6 ptp -155.26 135.4 13.06 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.593 0.757 . . . . 0.0 110.888 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.9 m -114.36 149.98 43.02 Favored Pre-proline 0 N--CA 1.479 0.99 0 C-N-CA 124.665 1.186 . . . . 0.0 108.893 171.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.89 152.19 77.4 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.295 1.997 . . . . 0.0 111.89 173.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.594 HD13 ' HA ' ' A' ' 100' ' ' HIS . 63.8 mt -72.1 87.27 1.07 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 170.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -135.89 90.18 2.56 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.673 0.789 . . . . 0.0 108.908 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 . . . . . 0 CA--C 1.551 0.982 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.291 -176.589 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.987 0 CA-C-O 120.713 0.063 . . . . 0.0 112.956 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.8 p -67.63 -18.94 65.15 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.419 1.088 . . . . 0.0 113.226 -176.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -85.37 -21.29 28.93 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.122 0.569 . . . . 0.0 112.283 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.97 -113.53 4.04 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.426 -0.652 . . . . 0.0 112.592 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -66.83 113.86 5.23 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 46.3 mtm180 -132.69 136.4 46.41 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.777 0.831 . . . . 0.0 111.003 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -74.51 106.42 6.1 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 173.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.68 -17.67 64.12 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -172.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.5 t -67.88 -35.15 71.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.007 0.523 . . . . 0.0 111.359 178.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -107.29 -37.62 6.2 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.196 0.522 . . . . 0.0 109.805 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.18 29.64 12.26 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.058 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -104.72 168.38 9.11 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.281 1.032 . . . . 0.0 109.717 176.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -72.99 124.31 25.22 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 167.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.2 pp -75.91 138.46 41.05 Favored 'General case' 0 C--N 1.357 0.923 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -149.84 94.29 2.15 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.123 0.569 . . . . 0.0 109.531 173.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.536 HD12 ' HB2' ' A' ' 125' ' ' MET . 2.4 tm? -172.24 143.38 1.47 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 105.827 -1.916 . . . . 0.0 105.827 170.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -127.61 113.62 16.32 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 175.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . 0.542 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 48.8 t -83.29 129.75 35.02 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -178.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -75.01 -41.42 59.42 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.422 0.689 . . . . 0.0 111.452 -175.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.6 ' HB2' ' HZ3' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -73.89 -39.57 63.8 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 120.901 0.382 . . . . 0.0 111.113 -179.654 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.542 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 26.4 t70 -80.6 -30.34 36.83 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.924 0.89 . . . . 0.0 110.687 -178.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.02 8.57 64.86 Favored Glycine 0 C--N 1.343 0.937 0 CA-C-N 115.552 -0.749 . . . . 0.0 114.449 176.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -116.92 -179.71 3.77 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.606 0.763 . . . . 0.0 109.925 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -103.01 109.86 21.56 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.613 0.765 . . . . 0.0 112.084 -172.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.7 mt -93.3 -175.58 3.87 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.857 0.863 . . . . 0.0 110.427 173.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.563 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 0.7 OUTLIER -111.84 149.51 31.7 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 164.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -60.33 -28.45 68.16 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.933 0.493 . . . . 0.0 112.006 -176.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.563 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 71.2 t -61.96 -42.06 93.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.388 0.675 . . . . 0.0 111.277 175.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 89.8 m -75.81 -17.61 59.79 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.009 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.417 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -77.7 -36.88 50.66 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.988 0.515 . . . . 0.0 110.58 169.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -84.57 -3.89 58.69 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.538 0.735 . . . . 0.0 111.414 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 46.9 t -73.16 152.81 40.98 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.641 0.777 . . . . 0.0 109.435 169.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -75.99 -26.23 56.54 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 173.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -61.28 101.03 0.14 Allowed 'General case' 0 C--N 1.357 0.904 0 C-N-CA 123.956 0.902 . . . . 0.0 111.372 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 20.5 m80 61.98 29.38 17.73 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.428 1.091 . . . . 0.0 112.15 167.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 25.6 ptt180 -61.81 125.49 24.03 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.578 0.751 . . . . 0.0 111.178 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.431 ' HB2' ' SD ' ' A' ' 125' ' ' MET . 38.3 m-20 -92.69 -174.26 3.59 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.122 -173.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 37.0 t-80 -110.88 -60.11 1.87 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -80.85 89.68 5.85 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.264 177.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.536 ' HB2' HD12 ' A' ' 101' ' ' LEU . 8.2 ptm -155.27 112.33 3.29 Favored 'General case' 0 CA--C 1.555 1.146 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.407 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 34.3 m -96.85 138.63 21.34 Favored Pre-proline 0 N--CA 1.491 1.618 0 C-N-CA 123.502 0.721 . . . . 0.0 111.38 -175.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . 0.415 ' HA ' HD22 ' A' ' 101' ' ' LEU . 58.2 Cg_endo -70.26 123.55 10.04 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.784 2.323 . . . . 0.0 114.312 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 82.7 mt -72.28 122.8 21.73 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 167.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -135.29 68.56 1.46 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.729 0.812 . . . . 0.0 109.5 178.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 . . . . . 0 CA--C 1.556 1.199 0 C-N-CA 123.842 0.857 . . . . 0.0 109.622 178.836 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.701 0 N-CA-C 112.277 -0.329 . . . . 0.0 112.277 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 36.3 p -67.52 -48.08 68.07 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.368 0.667 . . . . 0.0 110.618 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -95.02 112.09 23.83 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 171.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 153.46 105.86 0.27 Allowed Glycine 0 C--N 1.342 0.877 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.22 68.18 2.59 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 122.266 1.032 . . . . 0.0 108.719 173.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.504 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 54.2 mtt180 -134.6 136.9 43.26 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.347 -169.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 2.4 t -70.16 99.97 1.58 Allowed 'General case' 0 C--N 1.35 0.595 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 174.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.83 -20.77 65.2 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.451 0.7 . . . . 0.0 112.55 -170.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 50.8 t -63.26 -47.5 91.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 124.042 0.937 . . . . 0.0 111.042 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.519 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 0.8 OUTLIER -93.81 -28.2 16.02 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.727 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.53 27.82 31.54 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.115 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.519 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 9.8 pt-20 -110.27 169.93 8.42 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.835 1.254 . . . . 0.0 108.748 173.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.504 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 45.3 mtm105 -67.89 168.76 11.04 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 121.327 0.584 . . . . 0.0 110.523 168.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -124.72 136.74 54.14 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.99 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.528 ' HA ' HD11 ' A' ' 128' ' ' LEU . 75.2 m-70 -143.89 94.02 2.53 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 167.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.728 ' HG ' ' HB3' ' A' ' 115' ' ' ALA . 1.8 tm? -171.59 151.56 2.98 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.872 1.669 . . . . 0.0 106.52 171.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.46 ' N ' HD11 ' A' ' 101' ' ' LEU . 38.9 t80 -141.54 124.95 16.59 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 73.4 m -82.3 123.24 28.89 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.163 0.585 . . . . 0.0 109.991 175.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.593 ' HB2' ' HB2' ' A' ' 124' ' ' ALA . 10.9 mm-40 -74.88 -30.06 61.19 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 121.286 0.565 . . . . 0.0 111.416 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -89.78 -38.85 13.51 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.659 -176.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -89.72 -31.33 17.51 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.434 0.694 . . . . 0.0 110.743 -178.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.82 41.39 49.69 Favored Glycine 0 C--N 1.342 0.867 0 CA-C-N 115.741 -0.663 . . . . 0.0 113.779 177.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -133.05 144.43 50.02 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.461 0.704 . . . . 0.0 110.777 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.27 100.75 11.43 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.306 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 66.9 mt -92.02 -177.41 4.69 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.448 0.699 . . . . 0.0 110.322 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 5.6 p -103.35 165.79 10.82 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 168.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 49.6 t90 -64.71 -29.85 70.85 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.213 0.605 . . . . 0.0 111.724 -179.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.35 -39.68 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 122.839 0.456 . . . . 0.0 110.756 177.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 96.9 m -76.05 -17.09 59.8 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.021 0.529 . . . . 0.0 111.426 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.728 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -75.52 -49.1 19.73 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.213 0.605 . . . . 0.0 110.94 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -85.48 -28.23 25.15 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.441 -173.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 29.4 t -77.74 92.9 4.22 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 166.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -95.3 77.51 3.43 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.531 -166.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -71.2 -61.03 1.92 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.025 -0.989 . . . . 0.0 109.436 175.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 2.4 p-80 -165.84 110.54 0.84 Allowed 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.84 0.856 . . . . 0.0 110.526 172.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.53 ' HG2' ' SD ' ' A' ' 125' ' ' MET . 2.7 tpm_? -157.27 -55.72 0.08 Allowed 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 172.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 73.82 107.57 0.07 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 125.436 1.494 . . . . 0.0 114.047 167.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 70.6 t60 84.54 -70.64 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 125.18 1.392 . . . . 0.0 113.518 157.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.593 ' HB2' ' HB2' ' A' ' 104' ' ' GLU . . . -76.16 76.17 2.99 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 121.623 0.725 . . . . 0.0 112.119 -170.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.53 ' SD ' ' HG2' ' A' ' 121' ' ' ARG . 52.7 mmm -127.07 112.38 15.13 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.788 1.235 . . . . 0.0 108.097 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 33.2 m -116.37 151.39 46.83 Favored Pre-proline 0 N--CA 1.493 1.707 0 C-N-CA 123.47 0.708 . . . . 0.0 110.575 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -78.97 137.81 14.11 Favored 'Trans proline' 0 C--N 1.375 1.925 0 C-N-CA 122.719 2.28 . . . . 0.0 113.122 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.528 HD11 ' HA ' ' A' ' 100' ' ' HIS . 60.7 mt -71.66 97.05 1.66 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 171.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -136.97 46.24 2.2 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-O 122.567 1.175 . . . . 0.0 108.618 -174.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.8 mp0 . . . . . 0 CA--C 1.551 1.014 0 CA-C-N 114.561 -1.199 . . . . 0.0 108.831 176.695 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.117 0 CA-C-O 120.355 -0.136 . . . . 0.0 113.295 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 47.5 m -71.89 102.16 2.83 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 170.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -59.93 123.7 17.89 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.048 0.939 . . . . 0.0 110.594 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -72.97 -96.77 0.08 OUTLIER Glycine 0 C--N 1.341 0.819 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.333 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 58.45 21.13 8.13 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 124.959 1.304 . . . . 0.0 111.805 -177.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -126.39 128.52 47.17 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.837 0.855 . . . . 0.0 109.313 -178.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.4 t -68.59 100.64 1.15 Allowed 'General case' 0 C--N 1.349 0.573 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 174.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.06 -19.82 63.32 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.995 0.918 . . . . 0.0 112.496 -175.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.2 t -62.81 -38.68 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.096 0 C-N-CA 124.173 0.989 . . . . 0.0 111.434 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.422 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 2.1 m-70 -108.09 -39.27 5.55 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 120.88 0.371 . . . . 0.0 110.094 -177.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.42 52.3 2.37 Favored Glycine 0 C--N 1.347 1.166 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.138 -170.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.422 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.0 OUTLIER -146.69 161.21 41.07 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.501 1.12 . . . . 0.0 108.774 176.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 60.5 ttt85 -73.6 139.74 45.74 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.335 0.654 . . . . 0.0 110.995 -178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -105.44 137.16 43.72 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.216 1.007 . . . . 0.0 110.397 -176.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -141.02 93.29 2.57 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 165.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.47 HD12 ' N ' ' A' ' 102' ' ' PHE . 1.6 tm? -172.07 155.7 3.8 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 170.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.47 ' N ' HD12 ' A' ' 101' ' ' LEU . 33.0 t80 -153.5 121.55 6.11 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 171.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . 0.639 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 46.4 t -96.02 130.65 42.97 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 176.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -67.05 -47.9 69.92 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.612 0.765 . . . . 0.0 110.903 -175.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -75.96 -35.58 59.61 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -177.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.639 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 10.1 t70 -70.69 -33.11 70.55 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 176.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.42 30.85 78.82 Favored Glycine 0 C--N 1.342 0.902 0 CA-C-N 114.875 -1.057 . . . . 0.0 114.55 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -130.25 149.59 51.88 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.484 0.714 . . . . 0.0 109.585 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.98 100.27 9.6 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.652 -0.869 . . . . 0.0 108.652 174.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 75.5 mt -88.46 176.12 7.31 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.312 -176.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.47 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 12.6 p -115.28 173.13 6.67 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 172.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -59.21 -40.38 85.59 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 123.227 0.329 . . . . 0.0 111.358 176.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.47 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 59.2 t -61.65 -43.5 97.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.494 0.718 . . . . 0.0 111.484 -178.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.1 m -78.72 -18.22 54.64 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.442 0.297 . . . . 0.0 111.282 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -76.91 -43.94 33.69 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.412 0.685 . . . . 0.0 110.677 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -77.53 -16.92 58.4 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.337 0.655 . . . . 0.0 110.59 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 19.5 t -68.25 95.75 0.61 Allowed 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 172.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -72.31 88.79 1.18 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.217 1.007 . . . . 0.0 110.223 -175.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -121.96 -82.29 0.65 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.185 0.594 . . . . 0.0 111.19 -171.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -166.7 161.46 15.68 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.702 1.201 . . . . 0.0 109.8 -167.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 17.9 mtp180 65.56 25.39 11.73 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 124.353 1.033 . . . . 0.0 111.192 177.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -89.46 87.47 7.09 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.932 0.893 . . . . 0.0 110.218 -175.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -163.42 142.67 8.35 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.172 0.589 . . . . 0.0 110.709 173.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 54.35 58.07 5.28 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.712 1.205 . . . . 0.0 110.6 -177.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.468 ' HB3' HD11 ' A' ' 101' ' ' LEU . 90.0 mtp -101.74 106.46 17.47 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 21.1 m -104.77 149.37 37.42 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 124.281 1.032 . . . . 0.0 109.924 -177.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.01 151.4 50.11 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 122.097 1.864 . . . . 0.0 111.092 172.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 45.7 mt -78.43 84.77 4.57 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 121.478 0.656 . . . . 0.0 110.503 177.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -137.58 93.03 2.75 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.688 173.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 . . . . . 0 N--CA 1.478 0.968 0 C-N-CA 123.881 0.872 . . . . 0.0 110.06 -173.435 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.609 0 N-CA-C 111.89 -0.484 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 32.8 p -78.5 80.69 4.87 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-O 121.624 0.726 . . . . 0.0 109.781 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -84.29 155.79 22.24 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.981 -176.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 168.09 -177.69 42.15 Favored Glycine 0 C--N 1.338 0.669 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.326 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.27 32.74 1.9 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.201 1.0 . . . . 0.0 110.913 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -123.51 138.47 54.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.433 0.693 . . . . 0.0 110.739 -176.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.2 t -69.45 102.62 1.83 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.697 0.799 . . . . 0.0 108.967 174.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.8 -8.32 47.22 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.971 0.908 . . . . 0.0 113.148 -173.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 55.0 t -75.07 -38.92 43.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 C-N-CA 123.385 0.674 . . . . 0.0 111.042 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -106.67 -37.25 6.48 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 -176.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.89 32.8 6.64 Favored Glycine 0 N--CA 1.474 1.201 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.092 -173.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -118.74 167.01 12.08 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.608 1.163 . . . . 0.0 109.282 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -71.7 144.32 49.36 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.306 0.643 . . . . 0.0 109.45 172.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -106.33 136.82 45.39 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -144.49 95.4 2.7 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 167.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.441 HD12 ' HE3' ' A' ' 125' ' ' MET . 2.9 tm? -170.35 146.69 2.91 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 170.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.422 ' HB2' HD22 ' A' ' 128' ' ' LEU . 39.1 t80 -140.16 112.96 8.09 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 69.7 m -66.81 115.46 6.62 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.656 0.783 . . . . 0.0 110.231 173.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -69.24 -29.77 67.76 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.014 0.525 . . . . 0.0 111.537 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -84.12 -48.27 10.03 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.139 0.576 . . . . 0.0 111.42 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.91 -16.85 29.13 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.218 0.607 . . . . 0.0 111.073 -170.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.63 35.07 89.34 Favored Glycine 0 C--N 1.347 1.163 0 C-N-CA 123.573 0.606 . . . . 0.0 114.456 175.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -129.45 149.41 51.24 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.634 0.774 . . . . 0.0 110.48 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -95.28 103.05 14.9 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.453 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.6 mt -94.36 -179.3 4.87 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.516 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 10.6 p -111.43 173.81 6.17 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 171.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 32.2 t90 -59.07 -42.14 89.68 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.159 0.584 . . . . 0.0 111.5 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.75 -41.49 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.212 0 C-N-CA 123.565 0.746 . . . . 0.0 111.714 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.491 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 85.3 m -78.52 -14.05 59.54 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 122.58 0.352 . . . . 0.0 111.147 177.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.403 ' HB1' ' HG ' ' A' ' 101' ' ' LEU . . . -80.67 -49.27 11.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.255 0.622 . . . . 0.0 110.475 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -75.52 -16.94 60.23 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.008 0.923 . . . . 0.0 112.002 -173.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.2 p -71.5 -170.75 0.55 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.427 0.691 . . . . 0.0 111.789 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 20.0 tpp85 -68.89 79.16 0.31 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.74 0.816 . . . . 0.0 110.948 -178.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -140.06 -178.56 5.51 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.362 1.465 . . . . 0.0 109.535 -175.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.487 ' HB2' ' HB2' ' A' ' 123' ' ' HIS . 17.1 p-80 -65.98 78.96 0.08 Allowed 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 124.26 1.024 . . . . 0.0 110.673 175.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 13.0 mmm180 -64.59 103.25 0.65 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.689 0.796 . . . . 0.0 112.003 -171.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 66.96 24.78 9.52 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.112 1.365 . . . . 0.0 111.442 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.487 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 77.4 m80 -107.17 96.5 6.47 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.975 0.91 . . . . 0.0 109.229 176.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 57.43 68.84 0.8 Allowed 'General case' 0 C--O 1.246 0.879 0 C-N-CA 124.577 1.151 . . . . 0.0 111.99 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.441 ' HE3' HD12 ' A' ' 101' ' ' LEU . 21.3 ptm -157.63 116.0 3.15 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.357 -176.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.4 m -103.65 150.03 37.7 Favored Pre-proline 0 N--CA 1.483 1.205 0 C-N-CA 123.843 0.857 . . . . 0.0 110.31 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -80.52 139.6 12.87 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 122.163 1.909 . . . . 0.0 111.698 174.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.422 HD22 ' HB2' ' A' ' 102' ' ' PHE . 74.9 mt -76.07 105.36 7.07 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 120.977 0.417 . . . . 0.0 110.087 178.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -131.82 74.59 1.6 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.445 1.098 . . . . 0.0 109.231 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 . . . . . 0 CA--C 1.554 1.103 0 CA-C-N 114.717 -1.129 . . . . 0.0 110.633 179.25 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.502 0 N-CA-C 111.554 -0.618 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.6 p -89.75 8.89 29.46 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.194 0.998 . . . . 0.0 111.698 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -64.41 96.15 0.15 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.053 0.941 . . . . 0.0 110.581 177.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.89 99.28 0.68 Allowed Glycine 0 C--N 1.345 1.049 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.578 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -65.97 94.08 0.22 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.783 0.833 . . . . 0.0 110.222 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 65.8 mtm180 -132.28 134.86 45.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.593 1.157 . . . . 0.0 109.578 -175.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -69.09 101.78 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 171.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.51 -7.16 48.61 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.58 0.752 . . . . 0.0 112.603 -172.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -67.25 -50.93 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 123.484 0.714 . . . . 0.0 110.221 174.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -95.06 -36.99 11.31 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.655 -176.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.48 42.62 4.18 Favored Glycine 0 C--N 1.347 1.149 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.029 -175.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -126.45 156.63 40.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.155 0.982 . . . . 0.0 109.648 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -67.53 128.62 37.12 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.875 0.87 . . . . 0.0 109.771 172.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 pp -97.51 143.56 28.09 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 122.945 0.498 . . . . 0.0 110.565 -178.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -147.55 96.09 2.63 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 164.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.498 ' HG ' ' HB3' ' A' ' 115' ' ' ALA . 2.5 tm? -170.26 151.8 3.95 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 106.164 -1.791 . . . . 0.0 106.164 169.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.437 ' N ' HD12 ' A' ' 101' ' ' LEU . 32.7 t80 -137.15 115.84 12.12 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 175.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . 0.623 ' HB3' ' HB2' ' A' ' 106' ' ' ASP . 6.4 t -78.59 134.84 37.17 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.487 ' HB2' ' HB3' ' A' ' 124' ' ' ALA . 13.9 mm-40 -77.26 -40.14 45.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.774 0.43 . . . . 0.0 111.113 177.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -74.68 -42.01 59.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.674 0.389 . . . . 0.0 111.181 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.623 ' HB2' ' HB3' ' A' ' 103' ' ' CYS . 1.9 m-20 -81.3 -25.22 36.66 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.999 0.92 . . . . 0.0 110.958 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.23 25.14 69.51 Favored Glycine 0 C--N 1.355 1.611 0 O-C-N 123.383 0.427 . . . . 0.0 113.84 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -132.5 153.98 50.38 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.265 0.626 . . . . 0.0 110.705 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.66 103.41 7.58 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.822 0.849 . . . . 0.0 110.666 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 84.1 mt -94.43 -177.78 4.36 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.109 0.964 . . . . 0.0 110.861 176.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.492 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 4.7 p -112.12 162.59 15.26 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -53.02 -40.43 63.87 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.362 0.665 . . . . 0.0 112.401 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.492 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 62.1 t -60.6 -44.41 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 C-N-CA 123.676 0.79 . . . . 0.0 111.266 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.8 m -79.86 -19.45 48.3 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 122.586 0.354 . . . . 0.0 111.739 177.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.498 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -71.18 -53.73 13.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.359 0.664 . . . . 0.0 110.987 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -75.65 -14.6 60.37 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.257 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.8 t -66.59 110.81 3.33 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 123.662 0.785 . . . . 0.0 109.126 174.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -74.46 84.55 1.99 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.515 0.726 . . . . 0.0 110.133 -176.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -84.45 -49.83 8.3 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.585 1.154 . . . . 0.0 109.369 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -132.92 -158.66 0.9 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.534 1.534 . . . . 0.0 107.842 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -77.06 67.13 3.0 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 169.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -75.28 120.27 20.53 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.714 0.806 . . . . 0.0 109.938 -176.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -160.55 -51.42 0.05 OUTLIER 'General case' 0 C--O 1.24 0.576 0 C-N-CA 123.71 0.804 . . . . 0.0 109.44 -172.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.487 ' HB3' ' HB2' ' A' ' 104' ' ' GLU . . . -70.44 93.4 0.88 Allowed 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.43 175.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.3 ptp -159.18 151.13 20.81 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.141 0.977 . . . . 0.0 109.755 176.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 34.7 m -125.62 142.18 41.22 Favored Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 124.37 1.068 . . . . 0.0 109.336 176.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -73.65 126.11 10.57 Favored 'Trans proline' 0 C--N 1.373 1.867 0 C-N-CA 122.037 1.825 . . . . 0.0 111.981 176.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 49.0 mt -72.26 96.4 1.83 Allowed 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -123.04 139.46 54.06 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 173.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 123.593 0.757 . . . . 0.0 109.294 -177.56 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.89 0 CA-C-O 119.757 -0.468 . . . . 0.0 112.331 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.6 m 49.75 71.62 0.38 Allowed 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 125.189 1.395 . . . . 0.0 111.083 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -158.06 -177.41 6.54 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.268 -170.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.86 -130.38 9.67 Favored Glycine 0 C--N 1.347 1.186 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.643 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -142.94 42.8 1.57 Allowed 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 122.175 0.988 . . . . 0.0 109.969 -178.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.429 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 94.0 mtt180 -120.57 138.23 53.99 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 114.66 -1.155 . . . . 0.0 109.679 173.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -68.98 102.18 1.54 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 173.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.29 -20.52 62.99 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -169.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.5 t -67.24 -47.08 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.226 0.611 . . . . 0.0 111.13 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.547 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.0 OUTLIER -93.62 -38.66 11.23 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -177.079 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.69 36.92 6.64 Favored Glycine 0 C--N 1.35 1.357 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.889 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.547 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.4 OUTLIER -127.86 166.2 18.71 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.059 0.944 . . . . 0.0 109.97 176.453 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.429 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 2.9 tpt180 -71.17 124.87 25.44 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.217 1.007 . . . . 0.0 110.869 -173.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.8 pp -89.19 131.62 35.23 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 178.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -149.96 96.76 2.49 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.259 1.024 . . . . 0.0 108.612 165.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.529 ' HG ' ' HB3' ' A' ' 115' ' ' ALA . 3.1 tm? -168.74 149.76 4.64 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 174.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -139.17 118.01 12.4 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . 0.6 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 42.4 t -84.44 123.74 30.57 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 172.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -62.32 -46.93 86.53 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.864 0.865 . . . . 0.0 112.868 -169.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -87.84 -29.84 20.63 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -177.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.6 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 27.2 t70 -72.81 -32.86 65.84 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-O 121.049 0.452 . . . . 0.0 110.586 178.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.46 18.59 73.72 Favored Glycine 0 C--N 1.34 0.783 0 CA-C-N 115.274 -0.875 . . . . 0.0 115.214 173.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -112.53 153.07 28.06 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 117.825 0.813 . . . . 0.0 110.032 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.48 101.03 13.52 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.792 -1.094 . . . . 0.0 108.416 178.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.512 ' HB2' HD12 ' A' ' 101' ' ' LEU . 27.8 mt -91.8 -176.97 4.62 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.096 0.959 . . . . 0.0 109.554 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.625 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 2.9 p -111.19 158.82 18.49 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 171.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -60.9 -33.62 73.4 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.413 0.685 . . . . 0.0 110.997 178.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.625 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 60.4 t -58.55 -43.04 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 C-N-CA 123.585 0.754 . . . . 0.0 111.331 177.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 69.1 m -72.74 -29.87 63.69 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.728 177.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.529 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -68.56 -48.02 65.34 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.276 0.63 . . . . 0.0 111.244 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -78.03 -9.31 59.06 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.579 0.752 . . . . 0.0 112.018 -176.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 39.1 t -56.6 134.36 54.38 Favored 'General case' 0 C--O 1.247 0.948 0 C-N-CA 123.475 0.71 . . . . 0.0 109.894 174.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -64.78 115.5 5.36 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 124.288 0.992 . . . . 0.0 110.743 -172.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -109.81 165.95 11.3 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.419 1.088 . . . . 0.0 112.346 -174.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -63.36 -35.68 81.19 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 113.316 -1.765 . . . . 0.0 110.762 166.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -156.01 143.07 19.04 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 123.711 0.804 . . . . 0.0 109.798 -175.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -70.65 140.74 51.63 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.462 0.705 . . . . 0.0 109.43 170.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -126.0 161.8 26.72 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.336 0.654 . . . . 0.0 110.698 -174.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.98 98.08 1.55 Allowed 'General case' 0 C--N 1.347 0.468 0 C-N-CA 124.111 0.964 . . . . 0.0 110.503 -177.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.6 ptp -141.73 132.42 25.59 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.499 178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.5 m -112.13 144.46 30.81 Favored Pre-proline 0 N--CA 1.481 1.119 0 C-N-CA 124.999 1.32 . . . . 0.0 109.9 177.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.64 147.08 50.49 Favored 'Trans proline' 0 C--N 1.375 1.922 0 C-N-CA 122.538 2.159 . . . . 0.0 112.258 178.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 69.9 mt -78.72 92.31 4.77 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.142 0.577 . . . . 0.0 109.824 177.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -104.35 40.64 1.43 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.347 1.059 . . . . 0.0 109.04 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? . . . . . 0 CA--C 1.553 1.08 0 C-N-CA 124.045 0.938 . . . . 0.0 111.699 -175.201 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.691 0 N-CA-C 111.741 -0.543 . . . . 0.0 111.741 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 39.5 m -65.59 104.73 1.07 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 123.588 0.755 . . . . 0.0 109.402 177.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 58.75 76.81 0.33 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.624 1.169 . . . . 0.0 109.365 -170.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -77.84 66.17 3.11 Favored Glycine 0 C--N 1.35 1.324 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.669 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -92.73 27.93 2.2 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.867 1.267 . . . . 0.0 110.007 177.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -128.3 127.88 43.58 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.905 0.882 . . . . 0.0 109.918 -177.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -68.86 103.29 1.75 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.63 -23.5 51.49 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -168.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 46.3 t -59.8 -44.98 95.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.528 0.731 . . . . 0.0 111.549 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -104.84 -38.75 6.54 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -172.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.09 -6.46 58.24 Favored Glycine 0 C--N 1.349 1.252 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.533 -170.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -67.46 165.0 17.56 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.946 0.898 . . . . 0.0 110.205 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.91 132.68 43.79 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 170.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 pp -92.66 129.58 38.55 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 178.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -147.96 95.01 2.42 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 171.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.434 HD11 ' HE2' ' A' ' 125' ' ' MET . 2.9 tm? -171.14 121.32 0.53 Allowed 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 173.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -96.62 111.39 23.55 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 172.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 38.2 t -87.31 108.34 18.92 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -73.64 -19.97 60.7 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -174.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.545 ' HE3' ' SD ' ' A' ' 125' ' ' MET . 21.5 pttp -84.89 -36.43 21.5 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.253 0.621 . . . . 0.0 111.038 177.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -87.69 -26.9 22.74 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.297 0.639 . . . . 0.0 110.048 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.93 17.41 71.54 Favored Glycine 0 C--N 1.343 0.933 0 CA-C-N 115.015 -0.993 . . . . 0.0 113.804 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.405 ' HA ' ' HE3' ' A' ' 108' ' ' LYS . 0.0 OUTLIER -122.71 170.31 10.18 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 123.733 0.813 . . . . 0.0 110.181 -179.243 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.43 108.15 20.07 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.124 -173.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.1 mt -100.9 -177.2 3.39 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.711 1.204 . . . . 0.0 111.334 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.0 p -112.9 161.57 16.83 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 43.2 t90 -54.66 -44.15 73.01 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.025 0.93 . . . . 0.0 112.038 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.6 t -60.45 -41.0 85.96 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.661 0.785 . . . . 0.0 111.586 -176.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 97.1 m -75.37 -26.1 58.22 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.653 0.381 . . . . 0.0 111.594 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.65 -36.0 62.85 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.19 0.596 . . . . 0.0 111.001 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -94.92 -2.66 50.14 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.602 0.761 . . . . 0.0 111.715 -178.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t -68.42 -175.09 0.6 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.66 0.784 . . . . 0.0 111.41 -178.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 24.6 mmt180 -65.81 -4.42 6.62 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.049 0.94 . . . . 0.0 112.054 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -54.66 -70.68 0.1 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.993 1.317 . . . . 0.0 111.906 174.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 18.6 p-80 -172.9 -177.99 1.74 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.376 1.07 . . . . 0.0 109.97 -169.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -99.85 149.69 23.13 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.306 0.642 . . . . 0.0 109.724 171.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.738 ' HB2' ' HB2' ' A' ' 125' ' ' MET . 10.0 p-10 -82.76 107.4 15.35 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.541 0.737 . . . . 0.0 109.449 171.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -95.38 -62.89 1.22 Allowed 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 175.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -115.59 58.92 0.72 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.738 ' HB2' ' HB2' ' A' ' 122' ' ' ASP . 72.8 mtp -129.33 107.24 9.37 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 178.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 33.9 m -91.22 161.69 34.3 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.06 0.944 . . . . 0.0 110.006 -173.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -76.11 167.75 25.38 Favored 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 122.173 1.915 . . . . 0.0 112.28 174.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 15.5 mt -112.51 114.02 26.48 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.64 0.776 . . . . 0.0 111.411 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -141.35 56.62 1.53 Allowed 'General case' 0 C--O 1.241 0.646 0 C-N-CA 124.55 1.14 . . . . 0.0 108.142 169.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.55 0.954 0 CA-C-N 114.391 -1.277 . . . . 0.0 108.744 -178.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.255 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.5 t -133.56 14.49 4.07 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.102 0.961 . . . . 0.0 110.077 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -70.64 -17.9 62.86 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.026 0.931 . . . . 0.0 112.237 177.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 171.87 -179.01 43.82 Favored Glycine 0 C--N 1.343 0.933 0 N-CA-C 112.147 -0.381 . . . . 0.0 112.147 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.404 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -90.43 40.91 1.03 Allowed 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.186 0.994 . . . . 0.0 110.66 -177.682 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 84.9 mtt85 -110.04 132.38 54.22 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.578 -0.701 . . . . 0.0 110.638 -178.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -62.47 103.06 0.37 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.965 1.306 . . . . 0.0 109.517 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.02 -15.7 35.01 Favored 'General case' 0 N--CA 1.486 1.333 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -166.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 97.8 t -74.61 -43.97 47.38 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 123.16 0.584 . . . . 0.0 111.335 177.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -100.28 -39.91 7.79 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.222 0.534 . . . . 0.0 110.603 -173.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.05 -10.71 60.29 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.555 -168.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -74.28 145.78 43.72 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.632 0.773 . . . . 0.0 109.856 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 58.3 ttp180 -62.5 144.19 56.3 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.663 0.785 . . . . 0.0 110.894 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 2.7 pp -109.48 141.75 41.48 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 123.635 0.774 . . . . 0.0 110.498 -175.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -148.61 94.46 2.28 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 164.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.462 HD21 ' SD ' ' A' ' 125' ' ' MET . 1.5 tp -170.01 158.55 7.18 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.082 1.353 . . . . 0.0 108.363 172.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.424 ' H ' ' HG ' ' A' ' 101' ' ' LEU . 67.4 t80 -138.05 109.79 7.11 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.831 0.852 . . . . 0.0 109.892 177.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 97.4 m -65.61 110.89 2.91 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.737 0.815 . . . . 0.0 108.966 168.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -76.13 -32.55 59.18 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.876 0.87 . . . . 0.0 110.919 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.536 ' HB3' ' HB1' ' A' ' 124' ' ' ALA . 15.2 ptmm? -81.58 -11.94 58.95 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.487 -176.301 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -131.32 -27.82 1.95 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.614 0.366 . . . . 0.0 111.036 -172.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.96 40.34 21.44 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 116.084 -0.507 . . . . 0.0 113.592 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -120.02 153.61 35.78 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.822 0.849 . . . . 0.0 110.253 179.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.97 106.97 17.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.245 0.618 . . . . 0.0 109.729 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.7 mt -107.14 -175.74 2.88 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.469 0.707 . . . . 0.0 109.832 178.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.574 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 19.9 p -105.4 167.02 10.02 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 171.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 65.9 t90 -56.56 -36.27 69.13 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 124.236 1.015 . . . . 0.0 111.798 173.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.574 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 60.1 t -59.53 -37.53 70.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 123.479 0.712 . . . . 0.0 111.385 176.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 59.4 m -72.78 -23.32 60.79 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.894 0.478 . . . . 0.0 110.993 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.465 ' O ' ' HA ' ' A' ' 121' ' ' ARG . . . -87.9 -1.94 58.3 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.599 0.76 . . . . 0.0 111.717 173.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -120.22 12.82 11.88 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.358 0.663 . . . . 0.0 110.398 173.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 42.9 t -69.9 166.1 20.24 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 124.33 1.052 . . . . 0.0 111.916 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 12.1 tpp180 -62.5 -36.74 83.51 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.016 173.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -86.22 -45.49 11.26 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.486 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -123.7 135.87 54.12 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 122.73 0.412 . . . . 0.0 111.721 -172.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.465 ' HA ' ' O ' ' A' ' 115' ' ' ALA . 53.2 ttm-85 -146.46 -79.28 0.16 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.503 0.721 . . . . 0.0 111.002 176.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -103.35 37.87 1.9 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.143 0.977 . . . . 0.0 111.435 -166.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 76.3 m-70 -84.88 176.16 8.66 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.536 ' HB1' ' HB3' ' A' ' 105' ' ' LYS . . . -67.26 89.81 0.21 Allowed 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.063 0.459 . . . . 0.0 109.881 177.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.462 ' SD ' HD21 ' A' ' 101' ' ' LEU . 15.0 ptp -156.03 129.71 8.42 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 124.36 1.064 . . . . 0.0 109.255 -178.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.4 m -106.29 134.33 19.83 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 123.559 0.744 . . . . 0.0 109.895 175.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.85 120.32 7.24 Favored 'Trans proline' 0 C--N 1.368 1.589 0 C-N-CA 122.309 2.006 . . . . 0.0 110.625 174.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.5 mt -73.12 84.98 1.34 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.54 100.27 5.09 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 -178.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 . . . . . 0 CA--C 1.557 1.225 0 C-N-CA 123.778 0.831 . . . . 0.0 109.855 -169.474 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.884 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.2 p -68.1 -24.58 65.05 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.127 0.971 . . . . 0.0 112.976 -173.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -71.39 91.41 1.01 Allowed 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 175.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -103.39 82.76 0.4 Allowed Glycine 0 C--N 1.346 1.095 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.166 -175.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.21 25.16 0.74 Allowed 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 123.992 0.917 . . . . 0.0 110.584 172.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -122.4 134.09 54.62 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 125.749 1.62 . . . . 0.0 108.652 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 111' ' ' CYS . 18.8 t -64.61 103.26 0.65 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.0 -19.32 12.14 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -169.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.4 t -69.17 -51.29 44.86 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 123.368 0.667 . . . . 0.0 111.13 179.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -95.39 -38.4 10.51 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.008 0.432 . . . . 0.0 110.14 -173.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.16 17.79 36.05 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.413 -0.812 . . . . 0.0 113.759 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.414 ' OE2' ' HB3' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -105.4 166.72 10.23 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 117.676 0.738 . . . . 0.0 110.012 174.055 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -68.71 123.99 22.43 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.513 1.125 . . . . 0.0 110.633 -175.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.1 pp -90.7 131.07 36.6 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.495 0.718 . . . . 0.0 109.125 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -143.84 93.77 2.5 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 165.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.606 ' HG ' ' HB1' ' A' ' 115' ' ' ALA . 2.7 tm? -170.11 150.81 3.8 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 170.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.425 ' N ' HD11 ' A' ' 101' ' ' LEU . 84.1 t80 -144.52 110.43 5.39 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 176.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 43.9 t -86.28 112.85 21.78 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 178.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -73.6 -31.37 63.54 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.098 0.959 . . . . 0.0 111.596 -176.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.631 ' HB2' ' HZ3' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -78.83 -45.13 21.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.854 0.462 . . . . 0.0 111.111 177.951 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -79.89 -22.93 42.22 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.622 0.769 . . . . 0.0 109.985 -177.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.72 40.57 93.92 Favored Glycine 0 C--N 1.344 1.027 0 C-N-CA 123.905 0.764 . . . . 0.0 114.146 177.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -132.69 138.78 47.39 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.658 0.783 . . . . 0.0 110.61 177.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.04 100.21 8.06 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 169.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.563 ' HB2' HD12 ' A' ' 101' ' ' LEU . 83.7 mt -95.28 -178.47 4.46 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.67 0.788 . . . . 0.0 111.02 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.458 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 13.7 p -110.74 173.06 6.51 Favored 'General case' 0 C--O 1.244 0.792 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 172.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -59.34 -38.7 81.03 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.158 0.583 . . . . 0.0 111.617 175.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.458 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 41.7 t -62.72 -43.04 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 C-N-CA 123.529 0.731 . . . . 0.0 111.101 -178.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.8 m -78.71 -15.54 58.34 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.072 0.549 . . . . 0.0 111.45 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.606 ' HB1' ' HG ' ' A' ' 101' ' ' LEU . . . -78.74 -33.27 46.75 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.38 0.672 . . . . 0.0 110.331 173.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -80.57 -27.16 37.54 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.722 0.809 . . . . 0.0 110.274 175.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 48.0 t -68.81 110.72 4.49 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 50.4 mtp180 -90.64 38.69 0.95 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.257 1.023 . . . . 0.0 110.008 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -56.76 -42.51 79.5 Favored 'General case' 0 C--N 1.357 0.901 0 C-N-CA 124.996 1.318 . . . . 0.0 111.555 -177.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -115.87 -74.01 0.63 Allowed 'General case' 0 C--O 1.24 0.572 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -172.6 165.74 5.52 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.0 0.92 . . . . 0.0 110.207 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -94.81 -145.12 0.26 Allowed 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 124.769 1.228 . . . . 0.0 108.868 174.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 69.9 m80 77.95 140.93 0.07 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 125.616 1.567 . . . . 0.0 111.164 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 47.42 59.94 3.79 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 124.59 1.156 . . . . 0.0 111.815 176.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.467 ' HB3' HD13 ' A' ' 101' ' ' LEU . 20.9 mtm -136.06 109.95 8.18 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.803 0.841 . . . . 0.0 108.976 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 26.8 m -103.8 132.43 21.05 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 123.647 0.779 . . . . 0.0 110.184 177.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . 0.562 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 49.2 Cg_endo -67.32 141.84 58.0 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.303 2.002 . . . . 0.0 111.137 175.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 86.7 mt -75.14 100.6 4.31 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.127 0.489 . . . . 0.0 110.031 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -120.12 67.31 0.83 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 174.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 . . . . . 0 CA--C 1.558 1.283 0 C-N-CA 125.524 1.53 . . . . 0.0 110.16 -178.633 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.784 0 N-CA-C 110.789 -0.924 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.9 m -63.03 93.52 0.06 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.106 0.963 . . . . 0.0 111.868 -172.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.483 ' HB3' ' HB2' ' A' ' 91' ' ' ARG . 78.5 mm-40 -82.9 109.71 17.26 Favored 'General case' 0 C--O 1.242 0.705 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.843 175.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -74.43 -112.14 0.08 OUTLIER Glycine 0 C--N 1.35 1.322 0 N-CA-C 111.925 -0.47 . . . . 0.0 111.925 176.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 2.3 mp0 -83.54 64.8 8.1 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 168.52 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 32.8 mtp85 -130.86 131.45 44.57 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.622 0.769 . . . . 0.0 110.056 -173.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.5 t -69.46 101.47 1.58 Allowed 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.71 -10.76 55.26 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -169.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 60.8 t -68.73 -51.44 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.54 0.736 . . . . 0.0 110.558 175.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.414 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 1.5 m-70 -89.5 -31.84 17.47 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 -178.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.71 -0.37 67.48 Favored Glycine 0 C--N 1.351 1.416 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.123 -175.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.414 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 10.2 pt-20 -78.55 159.07 28.34 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.915 0.886 . . . . 0.0 111.086 -178.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.527 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 7.9 tpt180 -71.98 132.58 44.49 Favored 'General case' 0 CA--C 1.552 1.02 0 O-C-N 124.011 0.819 . . . . 0.0 109.158 167.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 4.1 pp -101.2 148.62 24.88 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 122.932 0.493 . . . . 0.0 110.17 -177.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.435 ' HA ' HD13 ' A' ' 128' ' ' LEU . 66.5 m80 -144.91 94.88 2.6 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 123.945 0.778 . . . . 0.0 109.096 167.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.552 ' HA ' ' HA ' ' A' ' 127' ' ' PRO . 3.2 tm? -170.43 115.4 0.48 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -95.16 113.17 24.82 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 35.8 t -85.43 112.92 21.31 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -75.87 -32.84 59.89 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.581 0.753 . . . . 0.0 111.612 -174.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 124' ' ' ALA . 21.2 ptmt -74.62 -39.51 62.09 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.711 0.404 . . . . 0.0 111.177 178.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -86.18 -26.59 25.04 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.616 0.766 . . . . 0.0 109.707 -177.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.41 27.19 73.04 Favored Glycine 0 C--N 1.341 0.857 0 C-N-CA 124.126 0.869 . . . . 0.0 113.811 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -131.73 152.99 50.51 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.73 0.812 . . . . 0.0 110.703 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.33 100.24 11.13 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.215 178.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.468 ' HB2' HD11 ' A' ' 101' ' ' LEU . 21.1 mt -89.61 -177.71 5.36 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.761 0.824 . . . . 0.0 109.893 175.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.524 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 1.3 p -112.44 160.72 17.47 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 173.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 47.5 t90 -52.28 -43.3 64.35 Favored 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 124.592 1.157 . . . . 0.0 112.253 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.524 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 95.7 t -59.16 -46.98 91.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 123.55 0.74 . . . . 0.0 111.594 -179.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 71.4 m -79.28 -14.76 58.81 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.668 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.447 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -82.16 -39.52 23.1 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.565 0.746 . . . . 0.0 110.65 177.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -91.83 14.75 14.59 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.205 0.602 . . . . 0.0 110.673 176.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 47.0 t -74.41 161.78 29.49 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.779 0.832 . . . . 0.0 110.304 169.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -61.66 -24.85 67.01 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.536 0.734 . . . . 0.0 111.452 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -63.06 -29.66 70.99 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.425 0.69 . . . . 0.0 112.141 178.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -125.02 161.73 26.09 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.246 0.619 . . . . 0.0 110.995 -176.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -139.61 -75.28 0.36 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.24 1.016 . . . . 0.0 108.934 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -170.95 101.06 0.22 Allowed 'General case' 0 C--O 1.239 0.518 0 N-CA-C 106.363 -1.717 . . . . 0.0 106.363 -177.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -127.75 -61.85 1.1 Allowed 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -168.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.401 ' HB2' ' HB3' ' A' ' 105' ' ' LYS . . . -175.08 86.27 0.04 OUTLIER 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 177.3 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.471 ' HB2' HD12 ' A' ' 101' ' ' LEU . 9.3 ptm -167.11 110.94 0.71 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.768 0.827 . . . . 0.0 109.959 -169.314 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.6 m -116.26 136.86 23.12 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.839 1.255 . . . . 0.0 110.063 -178.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . 0.552 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 28.6 Cg_endo -61.31 142.64 96.68 Favored 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.665 2.243 . . . . 0.0 113.124 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' A' ' 100' ' ' HIS . 93.2 mt -68.61 108.9 3.53 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.35 0.66 . . . . 0.0 109.503 175.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.14 64.34 8.33 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.4 0.68 . . . . 0.0 110.403 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 . . . . . 0 N--CA 1.475 0.821 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.498 -179.67 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.703 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 34.1 m -61.76 -36.99 82.64 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.647 0.779 . . . . 0.0 110.731 -178.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -87.95 44.73 1.21 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.287 1.035 . . . . 0.0 110.565 175.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.85 91.87 0.23 Allowed Glycine 0 C--N 1.348 1.198 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -68.23 78.44 0.25 Allowed 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.45 1.1 . . . . 0.0 110.505 -176.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.44 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 76.2 mtp180 -124.17 133.88 53.45 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.285 0.634 . . . . 0.0 110.998 -170.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.1 t -67.46 100.41 0.85 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 171.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.45 -13.7 62.27 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -168.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 98.8 t -61.93 -43.98 98.25 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 C-N-CA 123.21 0.604 . . . . 0.0 111.25 173.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -104.37 -38.02 6.99 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 121.508 0.671 . . . . 0.0 109.814 -176.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.79 -3.29 52.69 Favored Glycine 0 CA--C 1.532 1.133 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.616 -172.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.55 157.45 33.87 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 118.159 0.98 . . . . 0.0 109.911 177.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.44 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 36.1 ttp-105 -72.43 124.09 24.45 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 173.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -83.95 134.84 34.64 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.423 0.689 . . . . 0.0 109.584 -177.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -146.41 94.77 2.5 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 168.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.56 HD13 ' SD ' ' A' ' 125' ' ' MET . 2.4 tm? -171.79 153.46 3.32 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 171.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.44 ' N ' HD11 ' A' ' 101' ' ' LEU . 77.1 t80 -143.81 120.06 10.85 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 173.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 44.7 t -82.69 125.64 31.46 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -69.45 -32.4 71.32 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.061 0.944 . . . . 0.0 112.106 -177.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.521 ' HB2' ' HZ3' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -90.95 -41.55 11.07 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.716 0.407 . . . . 0.0 111.459 -178.007 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.445 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 37.0 t70 -78.85 -28.43 44.27 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.257 0.623 . . . . 0.0 110.723 -177.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.54 35.85 62.71 Favored Glycine 0 C--N 1.351 1.392 0 CA-C-N 116.027 -0.533 . . . . 0.0 114.22 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -133.67 147.09 51.39 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.328 0.651 . . . . 0.0 111.58 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.96 100.51 9.72 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.516 176.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 77.4 mt -100.62 -175.79 3.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.173 0.989 . . . . 0.0 111.008 -176.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.425 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 10.1 p -110.68 170.84 7.82 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 168.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 82.9 t90 -57.24 -47.01 82.44 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.807 0.443 . . . . 0.0 111.653 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.425 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 71.1 t -55.28 -47.61 77.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 C-N-CA 123.916 0.886 . . . . 0.0 112.387 -175.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 74.4 m -76.68 -19.72 57.42 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.548 0.339 . . . . 0.0 111.554 -178.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.21 -34.37 32.28 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.42 0.629 . . . . 0.0 110.567 177.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -114.45 17.56 17.33 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.252 -170.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 38.7 t -70.81 165.41 23.22 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 123.408 0.683 . . . . 0.0 110.302 175.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -60.57 138.99 57.97 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 80.26 -41.01 0.2 Allowed 'General case' 0 N--CA 1.498 1.959 0 C-N-CA 125.314 1.446 . . . . 0.0 110.912 -175.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -65.31 100.89 0.51 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.662 0.785 . . . . 0.0 109.032 175.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -85.33 157.18 20.61 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.622 0.769 . . . . 0.0 111.278 -171.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.62 102.77 2.34 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.213 0.605 . . . . 0.0 109.768 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 9.9 p-80 -123.63 -158.17 0.79 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.546 1.138 . . . . 0.0 108.604 173.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.64 89.36 0.15 Allowed 'General case' 0 CA--C 1.551 1.004 0 CA-C-O 121.399 0.619 . . . . 0.0 111.136 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.56 ' SD ' HD13 ' A' ' 101' ' ' LEU . 7.0 mmt -121.05 119.78 33.46 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.099 1.36 . . . . 0.0 108.374 177.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 36.0 m -117.7 145.71 37.08 Favored Pre-proline 0 N--CA 1.488 1.451 0 C-N-CA 123.703 0.801 . . . . 0.0 110.826 -176.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -70.66 151.63 64.07 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.869 2.379 . . . . 0.0 113.377 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 87.3 mt -94.39 134.09 37.27 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 168.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.19 165.99 23.81 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.07 0.948 . . . . 0.0 108.78 172.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 -175.574 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.394 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.9 t -148.44 -174.56 4.63 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.664 0.786 . . . . 0.0 110.056 -176.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -67.27 -179.9 1.1 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.28 1.032 . . . . 0.0 111.83 176.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -75.63 76.11 1.37 Allowed Glycine 0 C--N 1.348 1.208 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 173.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.519 ' HG3' ' HG3' ' A' ' 91' ' ' ARG . 6.3 pt-20 -84.55 -16.47 42.15 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.028 0.931 . . . . 0.0 111.305 176.311 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.519 ' HG3' ' HG3' ' A' ' 90' ' ' GLU . 60.9 mtt85 -118.96 136.09 54.26 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.476 1.111 . . . . 0.0 108.763 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 8.8 t -69.71 102.0 1.8 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 173.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.73 -20.03 63.06 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -170.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.3 t -62.53 -40.34 87.85 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.299 0 C-N-CA 123.973 0.909 . . . . 0.0 111.651 177.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.484 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.3 m-70 -107.59 -38.23 5.96 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.16 0.505 . . . . 0.0 110.095 -177.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.31 25.65 15.85 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.457 -0.792 . . . . 0.0 113.2 -176.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.484 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.0 OUTLIER -113.36 152.49 29.9 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.608 0.763 . . . . 0.0 109.535 174.13 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -70.21 122.94 20.45 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.315 0.646 . . . . 0.0 109.688 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.6 pp -80.97 138.61 36.08 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.985 -171.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -144.79 98.12 3.13 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.547 0.739 . . . . 0.0 109.78 167.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.676 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 1.9 tm? -168.28 143.09 3.48 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 105.243 -2.132 . . . . 0.0 105.243 169.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -129.69 115.23 17.03 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . 0.413 ' SG ' ' HG2' ' A' ' 105' ' ' LYS . 47.5 t -97.02 131.97 43.3 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.378 0.671 . . . . 0.0 109.386 179.018 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -74.3 -52.21 12.94 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.004 0.922 . . . . 0.0 111.121 -178.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.413 ' HG2' ' SG ' ' A' ' 103' ' ' CYS . 14.8 ptmm? -63.07 -38.66 92.07 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.042 0.537 . . . . 0.0 111.06 -176.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -83.66 -29.66 27.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.7 0.8 . . . . 0.0 109.857 -178.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.19 34.71 88.97 Favored Glycine 0 C--N 1.346 1.131 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.518 179.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -132.7 147.35 52.33 Favored 'General case' 0 C--O 1.242 0.67 0 C-N-CA 123.44 0.696 . . . . 0.0 110.738 -172.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.23 99.99 10.91 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 114.333 -1.303 . . . . 0.0 108.341 172.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 59.8 mt -93.9 -177.3 4.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.023 0.929 . . . . 0.0 110.242 179.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.506 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 2.8 p -108.9 159.68 16.61 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 173.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -58.85 -33.92 71.0 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.281 0.632 . . . . 0.0 111.765 177.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.506 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 28.6 t -63.69 -43.47 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.312 0 C-N-CA 123.622 0.769 . . . . 0.0 111.021 -179.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 91.5 m -77.73 -17.91 57.09 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 122.936 0.494 . . . . 0.0 111.186 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.676 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -73.52 -40.65 63.87 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 122.844 0.458 . . . . 0.0 110.304 170.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -87.19 -9.94 53.9 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.524 0.73 . . . . 0.0 112.369 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 80.4 p -72.72 108.99 6.01 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 168.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.9 ttt180 -77.42 10.08 2.8 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 122.804 0.442 . . . . 0.0 111.881 -169.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -62.6 -17.49 60.3 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.481 0.713 . . . . 0.0 111.011 163.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 46.7 m80 -104.4 -177.35 3.34 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.572 1.149 . . . . 0.0 108.79 174.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 -143.46 140.18 30.24 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 122.913 0.485 . . . . 0.0 109.768 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.84 98.94 0.21 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.321 1.048 . . . . 0.0 110.467 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -141.53 92.82 2.5 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 56.73 61.83 2.5 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.6 1.16 . . . . 0.0 111.321 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 84.0 mtp -122.24 109.1 14.05 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.5 m -108.03 162.71 18.91 Favored Pre-proline 0 N--CA 1.48 1.05 0 C-N-CA 124.488 1.115 . . . . 0.0 109.303 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -66.82 150.35 83.28 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 121.787 1.658 . . . . 0.0 110.877 171.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.457 ' HB2' ' N ' ' A' ' 101' ' ' LEU . 1.7 tt -69.37 97.24 0.95 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -178.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -145.48 130.45 18.28 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.053 0.941 . . . . 0.0 108.474 175.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 . . . . . 0 CA--C 1.553 1.064 0 C-N-CA 123.739 0.816 . . . . 0.0 110.119 179.649 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.097 0 N-CA-C 113.503 0.161 . . . . 0.0 113.503 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.7 t -90.68 -1.72 57.86 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.375 0.67 . . . . 0.0 110.682 175.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 56.4 71.23 0.58 Allowed 'General case' 0 C--N 1.358 0.963 0 C-N-CA 124.62 1.168 . . . . 0.0 109.498 -168.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -77.16 47.51 2.63 Favored Glycine 0 C--N 1.352 1.458 0 CA-C-N 116.014 -0.539 . . . . 0.0 113.103 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -94.67 5.53 51.59 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.77 1.228 . . . . 0.0 109.898 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 59.2 mtm-85 -115.34 135.0 54.59 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.843 1.257 . . . . 0.0 108.796 174.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.4 ' HB3' ' OE2' ' A' ' 97' ' ' GLU . 10.3 t -69.42 102.07 1.7 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 176.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -50.66 -30.13 12.82 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.842 1.257 . . . . 0.0 113.906 -172.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.71 -42.87 96.23 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.071 0 C-N-CA 123.421 0.689 . . . . 0.0 112.002 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.9 -37.79 8.09 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 120.997 0.427 . . . . 0.0 110.21 -175.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.91 3.88 54.64 Favored Glycine 0 C--N 1.346 1.108 0 CA-C-N 115.472 -0.786 . . . . 0.0 113.844 178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.4 ' OE2' ' HB3' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -94.79 166.46 11.97 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-N 117.765 0.782 . . . . 0.0 109.882 177.376 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -73.09 120.91 19.38 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.039 0.535 . . . . 0.0 110.142 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -80.17 136.99 36.61 Favored 'General case' 0 C--N 1.349 0.551 0 C-N-CA 123.711 0.804 . . . . 0.0 109.587 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -145.0 95.01 2.62 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 166.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.48 ' HG ' ' HB3' ' A' ' 115' ' ' ALA . 2.6 tm? -172.16 149.3 2.29 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 168.117 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.454 ' HB2' HD22 ' A' ' 128' ' ' LEU . 79.0 t80 -130.5 114.23 15.24 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 172.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 41.1 t -84.22 120.15 25.87 Favored 'General case' 0 C--O 1.227 -0.103 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 177.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -70.87 -39.59 72.79 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.613 0.765 . . . . 0.0 111.152 -172.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.563 ' HB2' ' HZ2' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -76.44 -34.47 58.76 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.224 -178.369 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.544 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 32.6 t70 -84.93 -26.62 27.11 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.011 0.924 . . . . 0.0 110.318 -179.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.65 13.96 69.27 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-N 114.373 -1.285 . . . . 0.0 114.81 176.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -113.98 150.02 34.46 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-N 117.415 0.607 . . . . 0.0 110.45 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.21 101.32 7.03 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.697 -1.138 . . . . 0.0 108.697 174.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 75.7 mt -94.92 -177.28 4.11 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.813 0.845 . . . . 0.0 110.58 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.614 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 9.7 p -111.81 168.25 9.73 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 173.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 26.4 t90 -65.04 -32.14 73.72 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 122.745 0.418 . . . . 0.0 111.197 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.614 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 44.2 t -59.43 -46.36 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 C-N-CA 123.681 0.792 . . . . 0.0 110.909 177.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 83.2 m -79.41 -19.2 50.6 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.895 0.478 . . . . 0.0 111.348 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.48 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -71.36 -49.44 42.26 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.188 0.595 . . . . 0.0 110.618 177.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -77.31 -18.42 57.51 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.28 0.632 . . . . 0.0 111.187 177.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 35.8 t -65.17 142.36 58.36 Favored 'General case' 0 C--N 1.355 0.826 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 173.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -65.79 121.39 14.92 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 123.988 0.805 . . . . 0.0 111.425 -170.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.493 ' HB2' ' HB3' ' A' ' 122' ' ' ASP . 0.0 OUTLIER -113.74 163.18 15.37 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 123.911 0.884 . . . . 0.0 109.948 178.833 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -60.94 -28.57 69.06 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.517 1.127 . . . . 0.0 111.114 175.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.529 ' HB3' ' HE2' ' A' ' 105' ' ' LYS . 28.3 tpt180 -165.94 91.44 0.48 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.546 1.138 . . . . 0.0 108.13 -177.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.493 ' HB3' ' HB2' ' A' ' 119' ' ' LYS . 3.5 p-10 -109.09 111.05 22.48 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.354 0.662 . . . . 0.0 110.618 -178.313 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -166.92 -46.88 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.811 0.844 . . . . 0.0 109.813 175.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.88 89.29 1.38 Allowed 'General case' 0 C--N 1.354 0.793 0 C-N-CA 123.637 0.775 . . . . 0.0 109.964 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 17.9 ptp -161.85 142.27 10.47 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.184 0.994 . . . . 0.0 109.949 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 17.4 m -127.96 150.17 72.85 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.039 1.336 . . . . 0.0 109.868 179.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -74.32 140.81 27.97 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 122.504 2.136 . . . . 0.0 112.383 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.454 HD22 ' HB2' ' A' ' 102' ' ' PHE . 74.8 mt -87.9 92.29 9.07 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 174.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -114.74 81.18 1.52 Allowed 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 171.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 . . . . . 0 CA--C 1.544 0.736 0 C-N-CA 124.374 1.069 . . . . 0.0 109.833 -172.637 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.9 0 N-CA-C 111.813 -0.515 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.8 p -99.42 90.37 4.51 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 121.424 0.63 . . . . 0.0 110.686 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.14 167.18 31.24 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.814 0.846 . . . . 0.0 109.796 177.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 73.92 73.18 0.93 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.182 177.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -62.4 122.15 15.0 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 171.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -129.34 135.27 48.52 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.75 0.42 . . . . 0.0 111.597 -172.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.9 t -73.16 102.05 3.49 Favored 'General case' 0 C--N 1.349 0.586 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 174.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.31 -20.26 62.72 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.165 0.986 . . . . 0.0 113.135 -174.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 16.0 t -67.09 -40.8 86.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 123.527 0.731 . . . . 0.0 111.252 -178.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.51 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 2.4 m-70 -103.49 -38.78 7.02 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 121.051 0.453 . . . . 0.0 109.951 -176.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.1 56.32 1.84 Allowed Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.162 -172.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.51 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 5.8 pt-20 -142.09 161.09 38.88 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.786 1.235 . . . . 0.0 109.531 -178.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -72.68 140.56 47.96 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 pp -114.08 140.21 48.67 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.35 0.66 . . . . 0.0 110.234 -177.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -142.37 95.27 2.77 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 164.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.502 HD11 ' SD ' ' A' ' 125' ' ' MET . 2.5 tm? -169.11 148.28 4.0 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.326 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -132.94 119.11 19.72 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.9 t -79.13 108.26 12.5 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 172.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.524 ' HB2' ' HB2' ' A' ' 124' ' ' ALA . 29.5 mt-10 -75.75 -34.82 60.31 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.66 0.384 . . . . 0.0 110.423 -178.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -69.47 -22.82 63.6 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.843 -178.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -111.22 -30.78 7.31 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.61 0.764 . . . . 0.0 110.673 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.48 48.35 10.82 Favored Glycine 0 C--N 1.336 0.539 0 CA-C-N 115.328 -0.851 . . . . 0.0 113.86 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -141.45 146.52 36.61 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.558 0.743 . . . . 0.0 110.857 175.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.427 ' HB1' HD11 ' A' ' 128' ' ' LEU . . . -81.18 107.3 13.85 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.847 0.859 . . . . 0.0 110.83 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.414 ' HB2' HD13 ' A' ' 101' ' ' LEU . 94.0 mt -102.54 -176.26 3.05 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.825 0.85 . . . . 0.0 110.591 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.591 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 4.5 p -108.5 159.23 16.86 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 172.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 62.6 t90 -52.38 -39.56 60.99 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.435 0.694 . . . . 0.0 111.937 175.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.591 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 48.2 t -57.91 -52.1 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 123.139 0.576 . . . . 0.0 111.509 179.063 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 88.9 m -72.92 -19.01 61.34 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 122.568 0.347 . . . . 0.0 111.655 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.404 ' HB3' ' HG ' ' A' ' 101' ' ' LEU . . . -72.19 -57.34 4.32 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 122.841 0.456 . . . . 0.0 110.386 176.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 21.3 mm-40 -74.37 -30.1 61.84 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.46 -173.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 30.8 t -73.65 94.45 2.19 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 168.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -133.32 147.2 51.86 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 -174.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -62.02 -51.03 69.65 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 177.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -104.53 -88.37 0.43 Allowed 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 172.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.573 ' HD3' ' H ' ' A' ' 122' ' ' ASP . 6.3 tpp180 -163.09 151.28 13.82 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.072 0.549 . . . . 0.0 110.497 -178.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.573 ' H ' ' HD3' ' A' ' 121' ' ' ARG . 2.4 m-20 -50.83 149.52 3.4 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.359 1.464 . . . . 0.0 112.379 178.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -125.26 -67.16 0.91 Allowed 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.568 0.747 . . . . 0.0 109.805 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.524 ' HB2' ' HB2' ' A' ' 104' ' ' GLU . . . -124.44 92.68 3.71 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -177.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.502 ' SD ' HD11 ' A' ' 101' ' ' LEU . 5.7 mmt -137.51 121.3 17.52 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.067 0.947 . . . . 0.0 109.472 -175.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.01 141.36 41.51 Favored Pre-proline 0 N--CA 1.489 1.508 0 C-N-CA 123.562 0.745 . . . . 0.0 109.955 176.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -70.23 150.81 65.88 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.457 2.105 . . . . 0.0 112.008 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.427 HD11 ' HB1' ' A' ' 109' ' ' ALA . 95.9 mt -80.85 86.0 6.08 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.156 0.503 . . . . 0.0 109.772 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -95.84 52.83 1.36 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.247 1.019 . . . . 0.0 110.656 -176.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 . . . . . 0 CA--C 1.551 0.994 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.67 -174.851 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -87.99 155.82 19.63 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.925 0.89 . . . . 0.0 110.224 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.55 100.63 3.94 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 170.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.49 -28.23 66.83 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.934 0.894 . . . . 0.0 112.371 -170.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 86.0 t -59.26 -43.37 89.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 123.565 0.746 . . . . 0.0 111.515 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -98.01 -37.81 9.62 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 121.125 0.488 . . . . 0.0 110.443 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.56 49.45 2.75 Favored Glycine 0 C--N 1.343 0.921 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.265 -174.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -138.48 161.64 36.51 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.338 0.655 . . . . 0.0 110.651 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -68.04 137.42 55.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.067 0.947 . . . . 0.0 109.159 170.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.3 pp -111.33 138.34 47.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.629 0.372 . . . . 0.0 110.991 -176.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.47 ' HA ' HD12 ' A' ' 128' ' ' LEU . 76.8 m-70 -141.11 96.61 3.03 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.586 0.754 . . . . 0.0 109.169 167.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.622 ' HA ' ' HA ' ' A' ' 127' ' ' PRO . 3.1 tm? -170.28 141.39 2.03 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 170.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -125.9 111.51 14.89 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 174.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' CYS . . . . . 0.465 ' SG ' HD12 ' A' ' 110' ' ' LEU . 75.0 m -73.72 112.31 9.7 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 168.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.408 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 27.6 mt-10 -74.13 -37.7 64.01 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 13.5 ptmm? -63.08 -46.98 84.85 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.859 177.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.539 ' HB3' ' HD3' ' A' ' 108' ' ' LYS . 6.9 m-20 -84.61 -28.98 26.13 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.33 0.652 . . . . 0.0 110.648 178.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.57 43.74 91.5 Favored Glycine 0 C--N 1.343 0.953 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.447 -172.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.539 ' HD3' ' HB3' ' A' ' 106' ' ' ASP . 58.4 mtpt -134.33 157.62 45.9 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.818 1.247 . . . . 0.0 109.865 -174.088 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -103.08 107.9 18.87 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.205 0.602 . . . . 0.0 110.047 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.465 HD12 ' SG ' ' A' ' 103' ' ' CYS . 68.8 mt -107.81 -175.55 2.81 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.896 0.878 . . . . 0.0 110.329 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.451 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 19.6 p -110.43 176.67 4.95 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.015 0.526 . . . . 0.0 110.117 173.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' TRP . . . . . 0.467 ' O ' ' HG2' ' A' ' 116' ' ' GLN . 51.7 t90 -56.99 -42.4 80.21 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.916 0.76 . . . . 0.0 110.87 173.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.451 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 43.8 t -61.05 -36.45 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 123.558 0.743 . . . . 0.0 111.461 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.456 ' HB2' ' HB3' ' A' ' 110' ' ' LEU . 89.5 m -78.14 -21.82 49.71 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.863 176.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.586 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -72.77 -34.92 67.28 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 170.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 112' ' ' TRP . 12.9 mm100 -79.55 -7.47 58.51 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.325 1.05 . . . . 0.0 111.451 177.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 C--N 1.353 0.719 0 C-N-CA 123.237 0.615 . . . . 0.0 110.839 -178.549 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.454 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . . . . . . 0 CA--C 1.534 0.362 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.457 ' HB3' HD11 ' A' ' 101' ' ' LEU . 23.7 mtm -144.2 119.01 9.88 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.126 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.2 m -121.49 137.71 27.33 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 123.929 0.892 . . . . 0.0 109.44 175.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.622 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 32.5 Cg_endo -61.9 155.26 56.01 Favored 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.425 2.083 . . . . 0.0 112.993 177.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.47 HD12 ' HA ' ' A' ' 100' ' ' HIS . 96.7 mt . . . . . 0 N--CA 1.478 0.933 0 C-N-CA 123.404 0.682 . . . . 0.0 110.276 -177.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 . . . . . 0 N--CA 1.469 0.52 0 CA-C-O 121.806 0.812 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -107.79 153.16 23.38 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 113.85 -1.523 . . . . 0.0 109.206 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.8 t -61.82 102.36 0.26 Allowed 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.4 -19.66 64.87 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.291 1.036 . . . . 0.0 113.228 -170.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 19.6 t -66.79 -40.8 86.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.443 0.697 . . . . 0.0 111.124 -178.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.434 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.5 m-70 -104.12 -38.22 7.01 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -177.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.35 37.08 5.2 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-N 114.802 -1.09 . . . . 0.0 112.356 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 1.6 pp20? -132.38 153.76 50.46 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.593 0.757 . . . . 0.0 109.969 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -66.1 133.31 50.46 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.692 0.797 . . . . 0.0 111.101 -173.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.5 pp -98.97 146.38 26.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.499 0.72 . . . . 0.0 110.041 -174.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -145.96 93.27 2.31 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 164.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.544 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -171.42 138.84 1.21 Allowed 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 173.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -125.84 115.91 20.72 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' CYS . . . . . 0.609 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 30.5 t -84.54 127.05 33.83 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -71.87 -45.54 60.96 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.779 0.832 . . . . 0.0 110.985 -175.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -69.61 -32.06 70.56 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.042 0.537 . . . . 0.0 111.273 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.609 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 29.4 t70 -94.08 -27.42 16.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.249 1.019 . . . . 0.0 110.818 -171.03 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.33 34.42 89.87 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-N 115.421 -0.809 . . . . 0.0 113.643 178.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -140.09 162.21 35.77 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.174 0.99 . . . . 0.0 110.084 -175.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -95.96 102.4 14.19 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.747 0.819 . . . . 0.0 110.808 -175.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.497 ' HB2' HD12 ' A' ' 101' ' ' LEU . 74.3 mt -91.54 -176.65 4.57 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.217 1.007 . . . . 0.0 110.499 176.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.4 p -116.29 172.94 6.87 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.15 0.58 . . . . 0.0 110.212 174.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 23.3 t90 -59.41 -47.04 86.98 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.906 0.882 . . . . 0.0 111.781 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 39.8 t -57.86 -39.89 73.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 123.561 0.538 . . . . 0.0 110.821 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 99.0 m -79.28 -26.84 42.29 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.106 0.562 . . . . 0.0 111.632 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.544 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -68.02 -37.09 80.99 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.043 0.537 . . . . 0.0 111.118 177.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -106.42 9.16 31.81 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.18 0.592 . . . . 0.0 111.584 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 44.0 t . . . . . 0 N--CA 1.484 1.244 0 C-N-CA 123.057 0.543 . . . . 0.0 110.248 179.254 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.48 ' HB2' HD11 ' A' ' 101' ' ' LEU . 2.0 ptm -169.78 129.66 0.99 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.017 -175.827 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.4 m -107.25 149.99 39.4 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 124.724 1.21 . . . . 0.0 109.412 174.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -76.24 140.52 22.24 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 122.432 2.088 . . . . 0.0 112.55 176.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 73.4 mt . . . . . 0 N--CA 1.478 0.974 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 173.309 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 . . . . . 0 C--O 1.241 0.647 0 CA-C-O 121.647 0.737 . . . . 0.0 111.444 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 85.0 mtt85 -120.37 151.05 39.8 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 114.271 -1.332 . . . . 0.0 110.198 -175.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -65.69 101.66 0.65 Allowed 'General case' 0 C--N 1.348 0.54 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.06 -29.12 67.08 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.821 0.848 . . . . 0.0 112.984 -171.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 47.4 t -57.14 -42.5 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 123.816 0.847 . . . . 0.0 111.756 -177.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -104.68 -35.07 7.93 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 -176.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.07 -3.3 55.37 Favored Glycine 0 N--CA 1.476 1.303 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.387 -175.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -83.44 164.31 19.99 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.077 0.951 . . . . 0.0 111.071 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.451 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 41.3 ttp180 -64.5 150.95 45.65 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.065 0.946 . . . . 0.0 110.429 173.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -117.37 141.37 48.4 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.829 0.452 . . . . 0.0 110.275 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 15.9 m80 -149.24 93.83 2.14 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 166.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.499 HD12 ' HB2' ' A' ' 110' ' ' LEU . 3.0 tm? -170.43 143.67 2.33 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 170.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -131.2 104.38 7.03 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 176.21 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 42.0 t -86.03 118.84 25.75 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -76.55 -39.68 52.08 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.225 0.61 . . . . 0.0 111.407 -174.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.16 -38.65 85.82 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.926 0.491 . . . . 0.0 111.34 177.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -81.51 -29.15 33.71 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.184 0.594 . . . . 0.0 110.129 177.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.2 36.1 92.44 Favored Glycine 0 C--N 1.343 0.96 0 CA-C-N 114.815 -1.084 . . . . 0.0 113.398 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -132.22 145.72 51.52 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 124.212 1.005 . . . . 0.0 109.903 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.72 99.74 9.1 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 171.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.499 ' HB2' HD12 ' A' ' 101' ' ' LEU . 83.9 mt -94.76 -176.75 3.97 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.855 0.862 . . . . 0.0 110.533 -178.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.496 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 7.0 p -113.54 164.49 13.57 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 172.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -59.42 -36.21 75.43 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.708 0.803 . . . . 0.0 111.702 178.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.496 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 84.6 t -60.43 -46.03 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 123.233 0.613 . . . . 0.0 111.135 178.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.6 m -78.63 -18.11 54.98 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.692 0.397 . . . . 0.0 111.253 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.33 -41.08 57.6 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.282 0.633 . . . . 0.0 110.201 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -78.76 -17.28 56.05 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.619 0.768 . . . . 0.0 110.803 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.5 t . . . . . 0 C--O 1.241 0.638 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.762 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.652 0 N-CA-C 110.387 -0.227 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 15.4 ptp -132.74 124.41 28.07 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.425 0.69 . . . . 0.0 109.148 167.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.3 m -104.33 136.85 19.12 Favored Pre-proline 0 CA--C 1.552 1.058 0 C-N-CA 123.731 0.813 . . . . 0.0 109.698 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.27 129.86 16.64 Favored 'Trans proline' 0 C--N 1.372 1.787 0 C-N-CA 122.596 2.197 . . . . 0.0 112.206 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 N--CA 1.471 0.606 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.584 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.509 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 82.7 mtp180 -125.61 132.87 52.42 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.849 -175.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -65.89 100.48 0.57 Allowed 'General case' 0 C--N 1.355 0.841 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 176.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.53 -24.61 63.82 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.784 0.834 . . . . 0.0 112.475 -173.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.09 -39.98 87.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 124.268 1.027 . . . . 0.0 111.789 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.479 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 1.9 m-70 -105.51 -31.86 8.78 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.18 -10.66 58.36 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-N 115.12 -0.945 . . . . 0.0 112.539 -175.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.479 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 9.4 pt-20 -73.62 179.34 4.18 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-N 117.429 0.615 . . . . 0.0 110.31 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.509 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 33.5 mtp-105 -69.54 -178.98 1.56 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.689 0.795 . . . . 0.0 111.899 172.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 pp -150.93 145.35 25.55 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.977 173.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 12.7 m170 -152.84 92.95 1.7 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 164.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' A' ' 110' ' ' LEU . 2.6 tm? -170.45 146.76 2.87 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.464 ' N ' HD13 ' A' ' 101' ' ' LEU . 60.2 t80 -140.36 108.53 5.77 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.311 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' CYS . . . . . 0.658 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 43.6 t -79.77 143.02 34.83 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -76.97 -39.98 48.57 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.281 0.632 . . . . 0.0 111.638 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -79.55 -46.42 17.37 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.436 0.294 . . . . 0.0 111.392 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.658 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 32.1 t70 -66.16 -31.74 72.77 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.173 0.589 . . . . 0.0 109.916 178.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.28 16.18 62.17 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.044 -0.98 . . . . 0.0 114.39 173.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -128.22 168.5 15.37 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.744 0.818 . . . . 0.0 109.257 -178.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -83.64 104.44 13.76 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.957 -1.019 . . . . 0.0 110.474 -177.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.526 ' HB2' HD12 ' A' ' 101' ' ' LEU . 82.9 mt -91.22 -179.01 5.31 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.7 0.8 . . . . 0.0 110.656 174.339 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.547 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 8.8 p -117.92 162.77 17.59 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 171.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -59.9 -33.89 72.45 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.72 0.808 . . . . 0.0 112.112 178.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.547 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 57.7 t -58.91 -44.0 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 C-N-CA 123.36 0.664 . . . . 0.0 110.786 175.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.46 -29.06 61.31 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.465 0.706 . . . . 0.0 111.018 177.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.435 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -67.51 -35.21 78.68 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.965 0.506 . . . . 0.0 111.241 178.117 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -78.03 -26.96 48.71 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.406 0.682 . . . . 0.0 111.111 177.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.9 t . . . . . 0 C--N 1.35 0.611 0 C-N-CA 123.286 0.634 . . . . 0.0 110.934 -177.135 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.686 0 CA-C-O 121.933 0.873 . . . . 0.0 109.586 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.1 ptp -148.23 156.47 42.6 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.096 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 31.4 m -125.9 147.07 57.62 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 124.644 1.177 . . . . 0.0 109.67 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.7 128.71 10.35 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 122.203 1.936 . . . . 0.0 112.069 174.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 57.6 mt . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 174.289 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.408 ' HG3' ' HA ' ' A' ' 98' ' ' ARG . 0.0 OUTLIER -122.83 138.34 54.67 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.46 0.704 . . . . 0.0 111.078 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.8 t -67.5 101.35 0.97 Allowed 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 169.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.08 -14.59 60.86 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -167.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 77.9 t -68.34 -46.03 81.48 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 123.059 0.544 . . . . 0.0 111.032 175.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -99.42 -39.54 8.32 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.005 0.431 . . . . 0.0 110.664 -174.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.62 2.52 53.08 Favored Glycine 0 CA--C 1.534 1.25 0 CA-C-N 115.4 -0.818 . . . . 0.0 113.16 -172.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -82.05 152.49 26.6 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 117.307 0.554 . . . . 0.0 109.702 177.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.408 ' HA ' ' HG3' ' A' ' 91' ' ' ARG . 54.1 ttp180 -70.09 119.71 14.69 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 123.561 0.744 . . . . 0.0 109.13 174.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -76.49 136.46 39.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -177.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.3 m80 -154.0 93.82 1.68 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.804 0.841 . . . . 0.0 109.234 172.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.474 HD13 ' N ' ' A' ' 102' ' ' PHE . 3.1 tm? -171.44 150.03 2.79 Favored 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 170.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.474 ' N ' HD13 ' A' ' 101' ' ' LEU . 61.2 t80 -138.68 110.94 7.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.335 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' CYS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 48.6 t -84.19 139.64 32.26 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -73.33 -53.65 10.28 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 122.723 0.409 . . . . 0.0 110.665 -174.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.97 -34.88 78.99 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.454 0.702 . . . . 0.0 112.513 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.456 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 30.3 t0 -82.83 -33.02 27.26 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 -177.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.36 25.71 67.1 Favored Glycine 0 C--N 1.351 1.397 0 CA-C-N 115.349 -0.842 . . . . 0.0 113.631 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -120.25 150.3 40.9 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.132 0.973 . . . . 0.0 109.901 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.26 100.52 11.27 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.149 176.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 28.4 mt -90.93 -178.24 5.16 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.344 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.6 p -112.76 178.08 4.41 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 46.8 t90 -63.41 -51.11 67.17 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.401 0.438 . . . . 0.0 111.872 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 97.5 t -61.7 -45.89 97.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 C-N-CA 123.287 0.635 . . . . 0.0 112.175 -174.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 96.7 m -68.99 -25.3 64.45 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 122.738 0.415 . . . . 0.0 111.838 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.96 -51.74 6.9 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 123.113 0.565 . . . . 0.0 111.227 -175.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -81.3 -10.85 59.49 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.734 -172.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 33.5 t . . . . . 0 CA--C 1.537 0.472 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 161.413 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.617 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 15.4 ptm -163.29 117.62 1.63 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.794 0.838 . . . . 0.0 109.409 -170.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 30.2 m -92.05 135.36 27.28 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 122.955 0.502 . . . . 0.0 109.995 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.26 120.65 6.07 Favored 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 122.26 1.974 . . . . 0.0 111.671 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 98.7 mt . . . . . 0 N--CA 1.472 0.625 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 169.99 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.591 ' HG2' ' HD2' ' A' ' 98' ' ' ARG . 69.4 mtt180 -127.69 136.44 51.58 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.913 0.885 . . . . 0.0 109.922 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.1 t -72.71 100.41 2.82 Favored 'General case' 0 C--N 1.354 0.792 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 175.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.78 -30.12 71.25 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.877 0.871 . . . . 0.0 111.861 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 67.8 t -52.46 -40.5 32.82 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 124.961 1.305 . . . . 0.0 112.314 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -103.99 -37.84 7.21 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.46 24.33 18.94 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 114.953 -1.022 . . . . 0.0 111.815 -171.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -103.33 178.72 4.47 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.591 ' HD2' ' HG2' ' A' ' 91' ' ' ARG . 4.7 tpt180 -74.93 166.26 23.94 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 123.759 0.824 . . . . 0.0 109.953 173.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.5 pp -133.6 134.7 43.59 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.526 -0.734 . . . . 0.0 110.594 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.592 ' HA ' HD12 ' A' ' 128' ' ' LEU . 78.7 m-70 -142.17 95.45 2.8 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 166.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.556 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -171.95 154.81 3.61 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 170.433 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.401 ' N ' HD13 ' A' ' 101' ' ' LEU . 87.9 t80 -135.4 116.09 13.9 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.451 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 28.8 t -85.65 124.18 31.9 Favored 'General case' 0 C--N 1.346 0.416 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -73.71 -44.93 55.08 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.408 0.683 . . . . 0.0 110.969 -173.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.3 -40.65 58.35 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.644 -178.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -78.2 -31.91 49.69 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.253 0.621 . . . . 0.0 110.067 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.18 -19.61 25.82 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.619 -0.719 . . . . 0.0 114.538 174.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -88.24 144.13 26.62 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 117.712 0.756 . . . . 0.0 111.45 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.423 ' HB1' HD11 ' A' ' 128' ' ' LEU . . . -73.4 114.81 12.03 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.738 174.559 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.48 ' HB2' HD12 ' A' ' 101' ' ' LEU . 82.9 mt -98.93 179.19 4.71 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.74 0.816 . . . . 0.0 110.706 -178.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 8.2 p -99.61 164.1 12.21 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 168.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 63.1 t90 -62.62 -36.01 81.41 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 123.42 0.45 . . . . 0.0 111.325 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 85.0 t -59.77 -40.56 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 C-N-CA 123.256 0.623 . . . . 0.0 111.357 176.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 66.8 m -74.68 -20.81 59.72 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.793 0.437 . . . . 0.0 111.157 177.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.556 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -74.85 -44.0 51.46 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.269 0.628 . . . . 0.0 110.968 176.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -96.24 5.71 50.42 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.983 0.913 . . . . 0.0 111.759 -176.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.245 0.84 0 C-N-CA 123.682 0.793 . . . . 0.0 110.99 -176.468 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.735 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 17.6 ptp -155.26 135.4 13.06 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.593 0.757 . . . . 0.0 110.888 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.9 m -114.36 149.98 43.02 Favored Pre-proline 0 N--CA 1.479 0.99 0 C-N-CA 124.665 1.186 . . . . 0.0 108.893 171.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.89 152.19 77.4 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.295 1.997 . . . . 0.0 111.89 173.224 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.592 HD12 ' HA ' ' A' ' 100' ' ' HIS . 63.8 mt . . . . . 0 N--CA 1.477 0.9 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 170.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 . . . . . 0 N--CA 1.48 1.027 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 46.3 mtm180 -132.69 136.4 46.41 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.777 0.831 . . . . 0.0 111.003 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -74.51 106.42 6.1 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 173.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.68 -17.67 64.12 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -172.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.5 t -67.88 -35.15 71.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.007 0.523 . . . . 0.0 111.359 178.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -107.29 -37.62 6.2 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.196 0.522 . . . . 0.0 109.805 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.18 29.64 12.26 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.058 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -104.72 168.38 9.11 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.281 1.032 . . . . 0.0 109.717 176.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -72.99 124.31 25.22 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 167.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.2 pp -75.91 138.46 41.05 Favored 'General case' 0 C--N 1.357 0.923 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -149.84 94.29 2.15 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.123 0.569 . . . . 0.0 109.531 173.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.549 HD11 ' HB2' ' A' ' 125' ' ' MET . 2.4 tm? -172.24 143.38 1.47 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 105.827 -1.916 . . . . 0.0 105.827 170.21 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.431 ' N ' HD13 ' A' ' 101' ' ' LEU . 73.9 t80 -127.61 113.62 16.32 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 175.264 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' CYS . . . . . 0.535 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 48.8 t -83.29 129.75 35.02 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -178.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -75.01 -41.42 59.42 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.422 0.689 . . . . 0.0 111.452 -175.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -39.57 63.8 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 120.901 0.382 . . . . 0.0 111.113 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.535 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 26.4 t70 -80.6 -30.34 36.83 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.924 0.89 . . . . 0.0 110.687 -178.001 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.02 8.57 64.86 Favored Glycine 0 C--N 1.343 0.937 0 CA-C-N 115.552 -0.749 . . . . 0.0 114.449 176.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -116.92 -179.71 3.77 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.606 0.763 . . . . 0.0 109.925 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -103.01 109.86 21.56 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.613 0.765 . . . . 0.0 112.084 -172.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.7 mt -93.3 -175.58 3.87 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.857 0.863 . . . . 0.0 110.427 173.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.558 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 0.7 OUTLIER -111.84 149.51 31.7 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 164.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -60.33 -28.45 68.16 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.933 0.493 . . . . 0.0 112.006 -176.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.558 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 71.2 t -61.96 -42.06 93.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.388 0.675 . . . . 0.0 111.277 175.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 89.8 m -75.81 -17.61 59.79 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.009 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.409 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -77.7 -36.88 50.66 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.988 0.515 . . . . 0.0 110.58 169.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -84.57 -3.89 58.69 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.538 0.735 . . . . 0.0 111.414 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.47 0.541 0 C-N-CA 123.641 0.777 . . . . 0.0 109.435 169.8 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.549 ' HB2' HD11 ' A' ' 101' ' ' LEU . 8.2 ptm -155.27 112.33 3.29 Favored 'General case' 0 CA--C 1.555 1.146 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.407 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 34.3 m -96.85 138.63 21.34 Favored Pre-proline 0 N--CA 1.491 1.618 0 C-N-CA 123.502 0.721 . . . . 0.0 111.38 -175.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.434 ' HA ' HD22 ' A' ' 101' ' ' LEU . 58.2 Cg_endo -70.26 123.55 10.04 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.784 2.323 . . . . 0.0 114.312 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 82.7 mt . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 167.545 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 . . . . . 0 N--CA 1.478 0.931 0 CA-C-O 122.266 1.032 . . . . 0.0 108.719 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.508 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 54.2 mtt180 -134.6 136.9 43.26 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.347 -169.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 2.4 t -70.16 99.97 1.58 Allowed 'General case' 0 C--N 1.35 0.595 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 174.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.83 -20.77 65.2 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.451 0.7 . . . . 0.0 112.55 -170.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 50.8 t -63.26 -47.5 91.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 124.042 0.937 . . . . 0.0 111.042 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.506 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 0.8 OUTLIER -93.81 -28.2 16.02 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.727 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.53 27.82 31.54 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.115 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.506 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 9.8 pt-20 -110.27 169.93 8.42 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.835 1.254 . . . . 0.0 108.748 173.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.508 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 45.3 mtm105 -67.89 168.76 11.04 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 121.327 0.584 . . . . 0.0 110.523 168.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -124.72 136.74 54.14 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.99 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.517 ' HA ' HD12 ' A' ' 128' ' ' LEU . 75.2 m-70 -143.89 94.02 2.53 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 167.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.778 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 1.8 tm? -171.59 151.56 2.98 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.872 1.669 . . . . 0.0 106.52 171.6 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.517 ' N ' HD13 ' A' ' 101' ' ' LEU . 38.9 t80 -141.54 124.95 16.59 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 73.4 m -82.3 123.24 28.89 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.163 0.585 . . . . 0.0 109.991 175.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.632 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 10.9 mm-40 -74.88 -30.06 61.19 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 121.286 0.565 . . . . 0.0 111.416 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -89.78 -38.85 13.51 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.659 -176.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -89.72 -31.33 17.51 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.434 0.694 . . . . 0.0 110.743 -178.085 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.82 41.39 49.69 Favored Glycine 0 C--N 1.342 0.867 0 CA-C-N 115.741 -0.663 . . . . 0.0 113.779 177.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -133.05 144.43 50.02 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.461 0.704 . . . . 0.0 110.777 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.27 100.75 11.43 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.306 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 66.9 mt -92.02 -177.41 4.69 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.448 0.699 . . . . 0.0 110.322 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 5.6 p -103.35 165.79 10.82 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 168.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 49.6 t90 -64.71 -29.85 70.85 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.213 0.605 . . . . 0.0 111.724 -179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.35 -39.68 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 122.839 0.456 . . . . 0.0 110.756 177.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 96.9 m -76.05 -17.09 59.8 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.021 0.529 . . . . 0.0 111.426 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.778 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -75.52 -49.1 19.73 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.213 0.605 . . . . 0.0 110.94 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -85.48 -28.23 25.15 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.441 -173.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 CA--C 1.544 0.744 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 166.328 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.632 ' HB1' ' HB2' ' A' ' 104' ' ' GLU . . . . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 121.623 0.725 . . . . 0.0 112.119 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.434 ' HB3' HD11 ' A' ' 101' ' ' LEU . 52.7 mmm -127.07 112.38 15.13 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.788 1.235 . . . . 0.0 108.097 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 33.2 m -116.37 151.39 46.83 Favored Pre-proline 0 N--CA 1.493 1.707 0 C-N-CA 123.47 0.708 . . . . 0.0 110.575 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -78.97 137.81 14.11 Favored 'Trans proline' 0 C--N 1.375 1.925 0 C-N-CA 122.719 2.28 . . . . 0.0 113.122 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 100' ' ' HIS . 60.7 mt . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 171.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 . . . . . 0 N--CA 1.494 1.755 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -126.39 128.52 47.17 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.837 0.855 . . . . 0.0 109.313 -178.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.4 t -68.59 100.64 1.15 Allowed 'General case' 0 C--N 1.349 0.573 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 174.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.06 -19.82 63.32 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.995 0.918 . . . . 0.0 112.496 -175.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.2 t -62.81 -38.68 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.096 0 C-N-CA 124.173 0.989 . . . . 0.0 111.434 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.431 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 2.1 m-70 -108.09 -39.27 5.55 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 120.88 0.371 . . . . 0.0 110.094 -177.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.42 52.3 2.37 Favored Glycine 0 C--N 1.347 1.166 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.138 -170.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.431 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.0 OUTLIER -146.69 161.21 41.07 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.501 1.12 . . . . 0.0 108.774 176.922 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 60.5 ttt85 -73.6 139.74 45.74 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.335 0.654 . . . . 0.0 110.995 -178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -105.44 137.16 43.72 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.216 1.007 . . . . 0.0 110.397 -176.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -141.02 93.29 2.57 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 165.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.523 HD11 ' HB3' ' A' ' 125' ' ' MET . 1.6 tm? -172.07 155.7 3.8 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 170.153 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.519 ' N ' HD13 ' A' ' 101' ' ' LEU . 33.0 t80 -153.5 121.55 6.11 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 171.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' CYS . . . . . 0.638 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 46.4 t -96.02 130.65 42.97 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 176.119 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -67.05 -47.9 69.92 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.612 0.765 . . . . 0.0 110.903 -175.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -75.96 -35.58 59.61 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -177.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.638 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 10.1 t70 -70.69 -33.11 70.55 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 176.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.42 30.85 78.82 Favored Glycine 0 C--N 1.342 0.902 0 CA-C-N 114.875 -1.057 . . . . 0.0 114.55 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -130.25 149.59 51.88 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.484 0.714 . . . . 0.0 109.585 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.98 100.27 9.6 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.652 -0.869 . . . . 0.0 108.652 174.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 75.5 mt -88.46 176.12 7.31 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.312 -176.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.467 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 12.6 p -115.28 173.13 6.67 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 172.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -59.21 -40.38 85.59 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 123.227 0.329 . . . . 0.0 111.358 176.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.467 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 59.2 t -61.65 -43.5 97.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.494 0.718 . . . . 0.0 111.484 -178.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.1 m -78.72 -18.22 54.64 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.442 0.297 . . . . 0.0 111.282 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.428 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -76.91 -43.94 33.69 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.412 0.685 . . . . 0.0 110.677 176.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -77.53 -16.92 58.4 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.337 0.655 . . . . 0.0 110.59 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 19.5 t . . . . . 0 CA--C 1.546 0.808 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 172.65 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.923 0 CA-C-O 121.909 0.861 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.523 ' HB3' HD11 ' A' ' 101' ' ' LEU . 90.0 mtp -101.74 106.46 17.47 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 21.1 m -104.77 149.37 37.42 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 124.281 1.032 . . . . 0.0 109.924 -177.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.01 151.4 50.11 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 122.097 1.864 . . . . 0.0 111.092 172.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 45.7 mt . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 121.478 0.656 . . . . 0.0 110.503 177.967 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 121.155 0.502 . . . . 0.0 110.913 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -123.51 138.47 54.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.433 0.693 . . . . 0.0 110.739 -176.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.2 t -69.45 102.62 1.83 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.697 0.799 . . . . 0.0 108.967 174.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.8 -8.32 47.22 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.971 0.908 . . . . 0.0 113.148 -173.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 55.0 t -75.07 -38.92 43.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 C-N-CA 123.385 0.674 . . . . 0.0 111.042 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -106.67 -37.25 6.48 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 -176.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.89 32.8 6.64 Favored Glycine 0 N--CA 1.474 1.201 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.092 -173.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -118.74 167.01 12.08 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.608 1.163 . . . . 0.0 109.282 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -71.7 144.32 49.36 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.306 0.643 . . . . 0.0 109.45 172.462 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -106.33 136.82 45.39 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -144.49 95.4 2.7 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 167.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.452 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.9 tm? -170.35 146.69 2.91 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 170.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.447 ' HB2' HD21 ' A' ' 128' ' ' LEU . 39.1 t80 -140.16 112.96 8.09 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 69.7 m -66.81 115.46 6.62 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.656 0.783 . . . . 0.0 110.231 173.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -69.24 -29.77 67.76 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.014 0.525 . . . . 0.0 111.537 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -84.12 -48.27 10.03 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.139 0.576 . . . . 0.0 111.42 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.91 -16.85 29.13 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.218 0.607 . . . . 0.0 111.073 -170.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.63 35.07 89.34 Favored Glycine 0 C--N 1.347 1.163 0 C-N-CA 123.573 0.606 . . . . 0.0 114.456 175.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -129.45 149.41 51.24 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.634 0.774 . . . . 0.0 110.48 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -95.28 103.05 14.9 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.453 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.6 mt -94.36 -179.3 4.87 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.516 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 10.6 p -111.43 173.81 6.17 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 171.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 32.2 t90 -59.07 -42.14 89.68 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.159 0.584 . . . . 0.0 111.5 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.75 -41.49 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.212 0 C-N-CA 123.565 0.746 . . . . 0.0 111.714 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.3 m -78.52 -14.05 59.54 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 122.58 0.352 . . . . 0.0 111.147 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.452 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -80.67 -49.27 11.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.255 0.622 . . . . 0.0 110.475 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -75.52 -16.94 60.23 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.008 0.923 . . . . 0.0 112.002 -173.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.2 p . . . . . 0 N--CA 1.482 1.171 0 C-N-CA 123.427 0.691 . . . . 0.0 111.789 179.42 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.879 0 CA-C-O 121.421 0.629 . . . . 0.0 111.99 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 21.3 ptm -157.63 116.0 3.15 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.357 -176.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.4 m -103.65 150.03 37.7 Favored Pre-proline 0 N--CA 1.483 1.205 0 C-N-CA 123.843 0.857 . . . . 0.0 110.31 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -80.52 139.6 12.87 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 122.163 1.909 . . . . 0.0 111.698 174.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.447 HD21 ' HB2' ' A' ' 102' ' ' PHE . 74.9 mt . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.977 0.417 . . . . 0.0 110.087 178.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 N--CA 1.473 0.724 0 CA-C-O 121.22 0.533 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 65.8 mtm180 -132.28 134.86 45.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.593 1.157 . . . . 0.0 109.578 -175.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -69.09 101.78 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 171.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.51 -7.16 48.61 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.58 0.752 . . . . 0.0 112.603 -172.177 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -67.25 -50.93 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 123.484 0.714 . . . . 0.0 110.221 174.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -95.06 -36.99 11.31 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.655 -176.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.48 42.62 4.18 Favored Glycine 0 C--N 1.347 1.149 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.029 -175.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -126.45 156.63 40.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.155 0.982 . . . . 0.0 109.648 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -67.53 128.62 37.12 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.875 0.87 . . . . 0.0 109.771 172.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 pp -97.51 143.56 28.09 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 122.945 0.498 . . . . 0.0 110.565 -178.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -147.55 96.09 2.63 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 164.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.5 tm? -170.26 151.8 3.95 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 106.164 -1.791 . . . . 0.0 106.164 169.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.469 ' N ' HD13 ' A' ' 101' ' ' LEU . 32.7 t80 -137.15 115.84 12.12 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 175.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' CYS . . . . . 0.637 ' HB3' ' HB2' ' A' ' 106' ' ' ASP . 6.4 t -78.59 134.84 37.17 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.569 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 13.9 mm-40 -77.26 -40.14 45.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.774 0.43 . . . . 0.0 111.113 177.406 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -74.68 -42.01 59.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.674 0.389 . . . . 0.0 111.181 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.637 ' HB2' ' HB3' ' A' ' 103' ' ' CYS . 1.9 m-20 -81.3 -25.22 36.66 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.999 0.92 . . . . 0.0 110.958 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.23 25.14 69.51 Favored Glycine 0 C--N 1.355 1.611 0 O-C-N 123.383 0.427 . . . . 0.0 113.84 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -132.5 153.98 50.38 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.265 0.626 . . . . 0.0 110.705 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.66 103.41 7.58 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.822 0.849 . . . . 0.0 110.666 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 84.1 mt -94.43 -177.78 4.36 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.109 0.964 . . . . 0.0 110.861 176.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.49 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 4.7 p -112.12 162.59 15.26 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -53.02 -40.43 63.87 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.362 0.665 . . . . 0.0 112.401 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.49 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 62.1 t -60.6 -44.41 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 C-N-CA 123.676 0.79 . . . . 0.0 111.266 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.8 m -79.86 -19.45 48.3 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 122.586 0.354 . . . . 0.0 111.739 177.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.534 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -71.18 -53.73 13.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.359 0.664 . . . . 0.0 110.987 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -75.65 -14.6 60.37 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.257 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--N 1.356 0.88 0 C-N-CA 123.662 0.785 . . . . 0.0 109.126 174.094 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.569 ' HB1' ' HB2' ' A' ' 104' ' ' GLU . . . . . . . . 0 CA--C 1.541 0.607 0 CA-C-O 120.999 0.428 . . . . 0.0 110.43 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.3 ptp -159.18 151.13 20.81 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.141 0.977 . . . . 0.0 109.755 176.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 34.7 m -125.62 142.18 41.22 Favored Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 124.37 1.068 . . . . 0.0 109.336 176.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -73.65 126.11 10.57 Favored 'Trans proline' 0 C--N 1.373 1.867 0 C-N-CA 122.037 1.825 . . . . 0.0 111.981 176.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 49.0 mt . . . . . 0 N--CA 1.473 0.684 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 172.434 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 122.175 0.988 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.424 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 94.0 mtt180 -120.57 138.23 53.99 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 114.66 -1.155 . . . . 0.0 109.679 173.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -68.98 102.18 1.54 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 173.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.29 -20.52 62.99 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -169.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.5 t -67.24 -47.08 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.226 0.611 . . . . 0.0 111.13 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.547 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.0 OUTLIER -93.62 -38.66 11.23 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -177.079 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.69 36.92 6.64 Favored Glycine 0 C--N 1.35 1.357 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.889 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.547 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.4 OUTLIER -127.86 166.2 18.71 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.059 0.944 . . . . 0.0 109.97 176.453 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.424 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 2.9 tpt180 -71.17 124.87 25.44 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.217 1.007 . . . . 0.0 110.869 -173.432 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.8 pp -89.19 131.62 35.23 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 178.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -149.96 96.76 2.49 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.259 1.024 . . . . 0.0 108.612 165.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.536 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 3.1 tm? -168.74 149.76 4.64 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 174.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -139.17 118.01 12.4 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' CYS . . . . . 0.59 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 42.4 t -84.44 123.74 30.57 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 172.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -62.32 -46.93 86.53 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.864 0.865 . . . . 0.0 112.868 -169.322 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -87.84 -29.84 20.63 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -177.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.59 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 27.2 t70 -72.81 -32.86 65.84 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-O 121.049 0.452 . . . . 0.0 110.586 178.205 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.46 18.59 73.72 Favored Glycine 0 C--N 1.34 0.783 0 CA-C-N 115.274 -0.875 . . . . 0.0 115.214 173.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -112.53 153.07 28.06 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 117.825 0.813 . . . . 0.0 110.032 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.48 101.03 13.52 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.792 -1.094 . . . . 0.0 108.416 178.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.495 ' HB2' HD12 ' A' ' 101' ' ' LEU . 27.8 mt -91.8 -176.97 4.62 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.096 0.959 . . . . 0.0 109.554 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.628 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 2.9 p -111.19 158.82 18.49 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 171.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -60.9 -33.62 73.4 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.413 0.685 . . . . 0.0 110.997 178.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.628 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 60.4 t -58.55 -43.04 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 C-N-CA 123.585 0.754 . . . . 0.0 111.331 177.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 69.1 m -72.74 -29.87 63.69 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.728 177.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.536 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -68.56 -48.02 65.34 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.276 0.63 . . . . 0.0 111.244 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -78.03 -9.31 59.06 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.579 0.752 . . . . 0.0 112.018 -176.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 39.1 t . . . . . 0 C--O 1.247 0.948 0 C-N-CA 123.475 0.71 . . . . 0.0 109.894 174.249 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 120.922 0.392 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.6 ptp -141.73 132.42 25.59 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.499 178.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.5 m -112.13 144.46 30.81 Favored Pre-proline 0 N--CA 1.481 1.119 0 C-N-CA 124.999 1.32 . . . . 0.0 109.9 177.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.64 147.08 50.49 Favored 'Trans proline' 0 C--N 1.375 1.922 0 C-N-CA 122.538 2.159 . . . . 0.0 112.258 178.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 69.9 mt . . . . . 0 N--CA 1.476 0.831 0 C-N-CA 123.142 0.577 . . . . 0.0 109.824 177.935 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 N--CA 1.475 0.796 0 CA-C-O 121.068 0.461 . . . . 0.0 110.007 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -128.3 127.88 43.58 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.905 0.882 . . . . 0.0 109.918 -177.111 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -68.86 103.29 1.75 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.63 -23.5 51.49 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -168.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 46.3 t -59.8 -44.98 95.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.528 0.731 . . . . 0.0 111.549 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -104.84 -38.75 6.54 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -172.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.09 -6.46 58.24 Favored Glycine 0 C--N 1.349 1.252 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.533 -170.628 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -67.46 165.0 17.56 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.946 0.898 . . . . 0.0 110.205 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.91 132.68 43.79 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 170.405 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 pp -92.66 129.58 38.55 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 178.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -147.96 95.01 2.42 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 171.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.475 HD11 ' HB3' ' A' ' 125' ' ' MET . 2.9 tm? -171.14 121.32 0.53 Allowed 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 173.465 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -96.62 111.39 23.55 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 172.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 38.2 t -87.31 108.34 18.92 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -73.64 -19.97 60.7 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -174.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.557 ' HE3' ' SD ' ' A' ' 125' ' ' MET . 21.5 pttp -84.89 -36.43 21.5 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.253 0.621 . . . . 0.0 111.038 177.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -87.69 -26.9 22.74 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.297 0.639 . . . . 0.0 110.048 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.93 17.41 71.54 Favored Glycine 0 C--N 1.343 0.933 0 CA-C-N 115.015 -0.993 . . . . 0.0 113.804 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 108' ' ' LYS . 0.0 OUTLIER -122.71 170.31 10.18 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 123.733 0.813 . . . . 0.0 110.181 -179.243 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.43 108.15 20.07 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.124 -173.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.1 mt -100.9 -177.2 3.39 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.711 1.204 . . . . 0.0 111.334 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.0 p -112.9 161.57 16.83 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 43.2 t90 -54.66 -44.15 73.01 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.025 0.93 . . . . 0.0 112.038 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.6 t -60.45 -41.0 85.96 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.661 0.785 . . . . 0.0 111.586 -176.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 97.1 m -75.37 -26.1 58.22 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.653 0.381 . . . . 0.0 111.594 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.65 -36.0 62.85 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.19 0.596 . . . . 0.0 111.001 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -94.92 -2.66 50.14 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.602 0.761 . . . . 0.0 111.715 -178.545 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 CA--C 1.551 1.018 0 C-N-CA 123.66 0.784 . . . . 0.0 111.41 -178.265 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.759 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.557 ' SD ' ' HE3' ' A' ' 105' ' ' LYS . 72.8 mtp -129.33 107.24 9.37 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 178.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 33.9 m -91.22 161.69 34.3 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.06 0.944 . . . . 0.0 110.006 -173.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -76.11 167.75 25.38 Favored 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 122.173 1.915 . . . . 0.0 112.28 174.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 15.5 mt . . . . . 0 N--CA 1.485 1.277 0 C-N-CA 123.64 0.776 . . . . 0.0 111.411 -177.484 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.417 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.521 0.677 . . . . 0.0 110.66 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 84.9 mtt85 -110.04 132.38 54.22 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.578 -0.701 . . . . 0.0 110.638 -178.078 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -62.47 103.06 0.37 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.965 1.306 . . . . 0.0 109.517 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.02 -15.7 35.01 Favored 'General case' 0 N--CA 1.486 1.333 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -166.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 97.8 t -74.61 -43.97 47.38 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 123.16 0.584 . . . . 0.0 111.335 177.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -100.28 -39.91 7.79 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.222 0.534 . . . . 0.0 110.603 -173.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.05 -10.71 60.29 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.555 -168.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -74.28 145.78 43.72 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.632 0.773 . . . . 0.0 109.856 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 58.3 ttp180 -62.5 144.19 56.3 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.663 0.785 . . . . 0.0 110.894 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 2.7 pp -109.48 141.75 41.48 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 123.635 0.774 . . . . 0.0 110.498 -175.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -148.61 94.46 2.28 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 164.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.459 HD21 ' SD ' ' A' ' 125' ' ' MET . 1.5 tp -170.01 158.55 7.18 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.082 1.353 . . . . 0.0 108.363 172.211 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.414 ' N ' ' HG ' ' A' ' 101' ' ' LEU . 67.4 t80 -138.05 109.79 7.11 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.831 0.852 . . . . 0.0 109.892 177.26 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 97.4 m -65.61 110.89 2.91 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.737 0.815 . . . . 0.0 108.966 168.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -76.13 -32.55 59.18 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.876 0.87 . . . . 0.0 110.919 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.537 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 15.2 ptmm? -81.58 -11.94 58.95 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.487 -176.301 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -131.32 -27.82 1.95 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.614 0.366 . . . . 0.0 111.036 -172.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.96 40.34 21.44 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 116.084 -0.507 . . . . 0.0 113.592 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -120.02 153.61 35.78 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.822 0.849 . . . . 0.0 110.253 179.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.97 106.97 17.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.245 0.618 . . . . 0.0 109.729 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.7 mt -107.14 -175.74 2.88 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.469 0.707 . . . . 0.0 109.832 178.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.574 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 19.9 p -105.4 167.02 10.02 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 171.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 65.9 t90 -56.56 -36.27 69.13 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 124.236 1.015 . . . . 0.0 111.798 173.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.574 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 60.1 t -59.53 -37.53 70.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 123.479 0.712 . . . . 0.0 111.385 176.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 59.4 m -72.78 -23.32 60.79 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.894 0.478 . . . . 0.0 110.993 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -87.9 -1.94 58.3 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.599 0.76 . . . . 0.0 111.717 173.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -120.22 12.82 11.88 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.358 0.663 . . . . 0.0 110.398 173.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 42.9 t . . . . . 0 C--O 1.243 0.761 0 C-N-CA 124.33 1.052 . . . . 0.0 111.916 -175.353 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.537 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 121.063 0.459 . . . . 0.0 109.881 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.459 ' SD ' HD21 ' A' ' 101' ' ' LEU . 15.0 ptp -156.03 129.71 8.42 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 124.36 1.064 . . . . 0.0 109.255 -178.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.4 m -106.29 134.33 19.83 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 123.559 0.744 . . . . 0.0 109.895 175.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.85 120.32 7.24 Favored 'Trans proline' 0 C--N 1.368 1.589 0 C-N-CA 122.309 2.006 . . . . 0.0 110.625 174.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.5 mt . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.707 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 121.284 0.564 . . . . 0.0 110.584 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -122.4 134.09 54.62 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 125.749 1.62 . . . . 0.0 108.652 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.445 ' HB2' ' HB3' ' A' ' 111' ' ' CYS . 18.8 t -64.61 103.26 0.65 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.0 -19.32 12.14 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -169.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.4 t -69.17 -51.29 44.86 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 123.368 0.667 . . . . 0.0 111.13 179.001 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -95.39 -38.4 10.51 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.008 0.432 . . . . 0.0 110.14 -173.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.16 17.79 36.05 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.413 -0.812 . . . . 0.0 113.759 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.425 ' OE2' ' HB3' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -105.4 166.72 10.23 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 117.676 0.738 . . . . 0.0 110.012 174.055 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -68.71 123.99 22.43 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.513 1.125 . . . . 0.0 110.633 -175.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.1 pp -90.7 131.07 36.6 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.495 0.718 . . . . 0.0 109.125 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -143.84 93.77 2.5 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 165.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.641 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -170.11 150.81 3.8 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 170.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.454 ' N ' HD13 ' A' ' 101' ' ' LEU . 84.1 t80 -144.52 110.43 5.39 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 176.427 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 43.9 t -86.28 112.85 21.78 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 178.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -73.6 -31.37 63.54 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.098 0.959 . . . . 0.0 111.596 -176.635 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.83 -45.13 21.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.854 0.462 . . . . 0.0 111.111 177.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -79.89 -22.93 42.22 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.622 0.769 . . . . 0.0 109.985 -177.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.72 40.57 93.92 Favored Glycine 0 C--N 1.344 1.027 0 C-N-CA 123.905 0.764 . . . . 0.0 114.146 177.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -132.69 138.78 47.39 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.658 0.783 . . . . 0.0 110.61 177.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.04 100.21 8.06 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 169.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.554 ' HB2' HD12 ' A' ' 101' ' ' LEU . 83.7 mt -95.28 -178.47 4.46 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.67 0.788 . . . . 0.0 111.02 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.456 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 13.7 p -110.74 173.06 6.51 Favored 'General case' 0 C--O 1.244 0.792 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 172.128 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -59.34 -38.7 81.03 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.158 0.583 . . . . 0.0 111.617 175.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.456 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 41.7 t -62.72 -43.04 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 C-N-CA 123.529 0.731 . . . . 0.0 111.101 -178.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.8 m -78.71 -15.54 58.34 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.072 0.549 . . . . 0.0 111.45 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.641 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -78.74 -33.27 46.75 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.38 0.672 . . . . 0.0 110.331 173.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -80.57 -27.16 37.54 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.722 0.809 . . . . 0.0 110.274 175.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--N 1.351 0.659 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.346 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.195 0 CA-C-O 121.11 0.481 . . . . 0.0 111.815 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.52 ' HB3' HD11 ' A' ' 101' ' ' LEU . 20.9 mtm -136.06 109.95 8.18 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.803 0.841 . . . . 0.0 108.976 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 26.8 m -103.8 132.43 21.05 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 123.647 0.779 . . . . 0.0 110.184 177.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.543 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 49.2 Cg_endo -67.32 141.84 58.0 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.303 2.002 . . . . 0.0 111.137 175.399 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 86.7 mt . . . . . 0 N--CA 1.47 0.553 0 CA-C-O 121.127 0.489 . . . . 0.0 110.031 -179.841 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.472 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 2.3 mp0 . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.522 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 32.8 mtp85 -130.86 131.45 44.57 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.622 0.769 . . . . 0.0 110.056 -173.002 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.5 t -69.46 101.47 1.58 Allowed 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.71 -10.76 55.26 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -169.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 60.8 t -68.73 -51.44 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.54 0.736 . . . . 0.0 110.558 175.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -89.5 -31.84 17.47 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 -178.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.71 -0.37 67.48 Favored Glycine 0 C--N 1.351 1.416 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.123 -175.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -78.55 159.07 28.34 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.915 0.886 . . . . 0.0 111.086 -178.143 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.522 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 7.9 tpt180 -71.98 132.58 44.49 Favored 'General case' 0 CA--C 1.552 1.02 0 O-C-N 124.011 0.819 . . . . 0.0 109.158 167.667 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 4.1 pp -101.2 148.62 24.88 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 122.932 0.493 . . . . 0.0 110.17 -177.597 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.428 ' HA ' HD12 ' A' ' 128' ' ' LEU . 66.5 m80 -144.91 94.88 2.6 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 123.945 0.778 . . . . 0.0 109.096 167.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.602 ' HA ' ' HA ' ' A' ' 127' ' ' PRO . 3.2 tm? -170.43 115.4 0.48 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.453 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -95.16 113.17 24.82 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 35.8 t -85.43 112.92 21.31 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -75.87 -32.84 59.89 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.581 0.753 . . . . 0.0 111.612 -174.67 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 21.2 ptmt -74.62 -39.51 62.09 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.711 0.404 . . . . 0.0 111.177 178.352 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -86.18 -26.59 25.04 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.616 0.766 . . . . 0.0 109.707 -177.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.41 27.19 73.04 Favored Glycine 0 C--N 1.341 0.857 0 C-N-CA 124.126 0.869 . . . . 0.0 113.811 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -131.73 152.99 50.51 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.73 0.812 . . . . 0.0 110.703 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.33 100.24 11.13 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.215 178.017 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.473 ' HB2' HD12 ' A' ' 101' ' ' LEU . 21.1 mt -89.61 -177.71 5.36 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.761 0.824 . . . . 0.0 109.893 175.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.52 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 1.3 p -112.44 160.72 17.47 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 173.506 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 47.5 t90 -52.28 -43.3 64.35 Favored 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 124.592 1.157 . . . . 0.0 112.253 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.52 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 95.7 t -59.16 -46.98 91.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 123.55 0.74 . . . . 0.0 111.594 -179.254 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 71.4 m -79.28 -14.76 58.81 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.668 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.481 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -82.16 -39.52 23.1 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.565 0.746 . . . . 0.0 110.65 177.021 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -91.83 14.75 14.59 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.205 0.602 . . . . 0.0 110.673 176.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 N--CA 1.473 0.719 0 C-N-CA 123.779 0.832 . . . . 0.0 110.304 169.132 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.402 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . . . . . . 0 C--O 1.237 0.408 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.544 ' HB2' HD11 ' A' ' 101' ' ' LEU . 9.3 ptm -167.11 110.94 0.71 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.768 0.827 . . . . 0.0 109.959 -169.314 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.6 m -116.26 136.86 23.12 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.839 1.255 . . . . 0.0 110.063 -178.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' PRO . . . . . 0.602 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 28.6 Cg_endo -61.31 142.64 96.68 Favored 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.665 2.243 . . . . 0.0 113.124 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 100' ' ' HIS . 93.2 mt . . . . . 0 N--CA 1.477 0.909 0 C-N-CA 123.35 0.66 . . . . 0.0 109.503 175.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 . . . . . 0 N--CA 1.482 1.169 0 CA-C-O 120.666 0.27 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.427 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 76.2 mtp180 -124.17 133.88 53.45 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.285 0.634 . . . . 0.0 110.998 -170.438 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.1 t -67.46 100.41 0.85 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 171.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.45 -13.7 62.27 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -168.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 98.8 t -61.93 -43.98 98.25 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 C-N-CA 123.21 0.604 . . . . 0.0 111.25 173.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -104.37 -38.02 6.99 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 121.508 0.671 . . . . 0.0 109.814 -176.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.79 -3.29 52.69 Favored Glycine 0 CA--C 1.532 1.133 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.616 -172.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.55 157.45 33.87 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 118.159 0.98 . . . . 0.0 109.911 177.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.427 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 36.1 ttp-105 -72.43 124.09 24.45 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 173.661 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -83.95 134.84 34.64 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.423 0.689 . . . . 0.0 109.584 -177.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -146.41 94.77 2.5 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 168.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.553 HD11 ' SD ' ' A' ' 125' ' ' MET . 2.4 tm? -171.79 153.46 3.32 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 171.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.467 ' N ' HD13 ' A' ' 101' ' ' LEU . 77.1 t80 -143.81 120.06 10.85 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 173.601 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' CYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 44.7 t -82.69 125.64 31.46 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.13 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -69.45 -32.4 71.32 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.061 0.944 . . . . 0.0 112.106 -177.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.95 -41.55 11.07 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.716 0.407 . . . . 0.0 111.459 -178.007 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.427 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 37.0 t70 -78.85 -28.43 44.27 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.257 0.623 . . . . 0.0 110.723 -177.36 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.54 35.85 62.71 Favored Glycine 0 C--N 1.351 1.392 0 CA-C-N 116.027 -0.533 . . . . 0.0 114.22 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -133.67 147.09 51.39 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.328 0.651 . . . . 0.0 111.58 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.96 100.51 9.72 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.516 176.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 77.4 mt -100.62 -175.79 3.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.173 0.989 . . . . 0.0 111.008 -176.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.421 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 10.1 p -110.68 170.84 7.82 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 168.063 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 82.9 t90 -57.24 -47.01 82.44 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.807 0.443 . . . . 0.0 111.653 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.421 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 71.1 t -55.28 -47.61 77.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 C-N-CA 123.916 0.886 . . . . 0.0 112.387 -175.726 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 74.4 m -76.68 -19.72 57.42 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.548 0.339 . . . . 0.0 111.554 -178.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.21 -34.37 32.28 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.42 0.629 . . . . 0.0 110.567 177.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -114.45 17.56 17.33 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.252 -170.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 38.7 t . . . . . 0 C--O 1.244 0.774 0 C-N-CA 123.408 0.683 . . . . 0.0 110.302 175.536 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.004 0 CA-C-O 121.399 0.619 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.553 ' SD ' HD11 ' A' ' 101' ' ' LEU . 7.0 mmt -121.05 119.78 33.46 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.099 1.36 . . . . 0.0 108.374 177.212 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 36.0 m -117.7 145.71 37.08 Favored Pre-proline 0 N--CA 1.488 1.451 0 C-N-CA 123.703 0.801 . . . . 0.0 110.826 -176.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -70.66 151.63 64.07 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.869 2.379 . . . . 0.0 113.377 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 87.3 mt . . . . . 0 N--CA 1.468 0.448 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 168.653 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.516 ' HG3' ' HG3' ' A' ' 91' ' ' ARG . 6.3 pt-20 . . . . . 0 N--CA 1.481 1.098 0 CA-C-O 120.891 0.377 . . . . 0.0 111.305 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.516 ' HG3' ' HG3' ' A' ' 90' ' ' GLU . 60.9 mtt85 -118.96 136.09 54.26 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.476 1.111 . . . . 0.0 108.763 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 8.8 t -69.71 102.0 1.8 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 173.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.73 -20.03 63.06 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -170.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.3 t -62.53 -40.34 87.85 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.299 0 C-N-CA 123.973 0.909 . . . . 0.0 111.651 177.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.49 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.3 m-70 -107.59 -38.23 5.96 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.16 0.505 . . . . 0.0 110.095 -177.291 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.31 25.65 15.85 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.457 -0.792 . . . . 0.0 113.2 -176.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.49 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.0 OUTLIER -113.36 152.49 29.9 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.608 0.763 . . . . 0.0 109.535 174.13 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -70.21 122.94 20.45 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.315 0.646 . . . . 0.0 109.688 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.6 pp -80.97 138.61 36.08 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.985 -171.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -144.79 98.12 3.13 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.547 0.739 . . . . 0.0 109.78 167.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.686 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 1.9 tm? -168.28 143.09 3.48 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 105.243 -2.132 . . . . 0.0 105.243 169.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.407 ' N ' HD13 ' A' ' 101' ' ' LEU . 37.9 t80 -129.69 115.23 17.03 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.457 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' CYS . . . . . 0.43 ' SG ' ' HG2' ' A' ' 105' ' ' LYS . 47.5 t -97.02 131.97 43.3 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.378 0.671 . . . . 0.0 109.386 179.018 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -74.3 -52.21 12.94 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.004 0.922 . . . . 0.0 111.121 -178.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.43 ' HG2' ' SG ' ' A' ' 103' ' ' CYS . 14.8 ptmm? -63.07 -38.66 92.07 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.042 0.537 . . . . 0.0 111.06 -176.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -83.66 -29.66 27.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.7 0.8 . . . . 0.0 109.857 -178.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.19 34.71 88.97 Favored Glycine 0 C--N 1.346 1.131 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.518 179.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -132.7 147.35 52.33 Favored 'General case' 0 C--O 1.242 0.67 0 C-N-CA 123.44 0.696 . . . . 0.0 110.738 -172.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.23 99.99 10.91 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 114.333 -1.303 . . . . 0.0 108.341 172.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 59.8 mt -93.9 -177.3 4.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.023 0.929 . . . . 0.0 110.242 179.066 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.505 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 2.8 p -108.9 159.68 16.61 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 173.334 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -58.85 -33.92 71.0 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.281 0.632 . . . . 0.0 111.765 177.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.505 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 28.6 t -63.69 -43.47 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.312 0 C-N-CA 123.622 0.769 . . . . 0.0 111.021 -179.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 91.5 m -77.73 -17.91 57.09 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 122.936 0.494 . . . . 0.0 111.186 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.686 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -73.52 -40.65 63.87 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 122.844 0.458 . . . . 0.0 110.304 170.581 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -87.19 -9.94 53.9 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.524 0.73 . . . . 0.0 112.369 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 80.4 p . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 168.813 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.938 0 CA-C-O 121.462 0.649 . . . . 0.0 111.321 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 84.0 mtp -122.24 109.1 14.05 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.5 m -108.03 162.71 18.91 Favored Pre-proline 0 N--CA 1.48 1.05 0 C-N-CA 124.488 1.115 . . . . 0.0 109.303 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -66.82 150.35 83.28 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 121.787 1.658 . . . . 0.0 110.877 171.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.468 ' HB2' ' N ' ' A' ' 101' ' ' LEU . 1.7 tt . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 59.2 mtm-85 -115.34 135.0 54.59 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.843 1.257 . . . . 0.0 108.796 174.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.409 ' HB3' ' OE2' ' A' ' 97' ' ' GLU . 10.3 t -69.42 102.07 1.7 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 176.171 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -50.66 -30.13 12.82 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.842 1.257 . . . . 0.0 113.906 -172.101 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.71 -42.87 96.23 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.071 0 C-N-CA 123.421 0.689 . . . . 0.0 112.002 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.9 -37.79 8.09 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 120.997 0.427 . . . . 0.0 110.21 -175.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.91 3.88 54.64 Favored Glycine 0 C--N 1.346 1.108 0 CA-C-N 115.472 -0.786 . . . . 0.0 113.844 178.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.409 ' OE2' ' HB3' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -94.79 166.46 11.97 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-N 117.765 0.782 . . . . 0.0 109.882 177.376 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -73.09 120.91 19.38 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.039 0.535 . . . . 0.0 110.142 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -80.17 136.99 36.61 Favored 'General case' 0 C--N 1.349 0.551 0 C-N-CA 123.711 0.804 . . . . 0.0 109.587 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -145.0 95.01 2.62 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 166.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.532 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.6 tm? -172.16 149.3 2.29 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 168.117 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.476 ' HB2' HD21 ' A' ' 128' ' ' LEU . 79.0 t80 -130.5 114.23 15.24 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 172.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' CYS . . . . . 0.536 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 41.1 t -84.22 120.15 25.87 Favored 'General case' 0 C--O 1.227 -0.103 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 177.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -70.87 -39.59 72.79 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.613 0.765 . . . . 0.0 111.152 -172.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.44 -34.47 58.76 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.224 -178.369 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.536 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 32.6 t70 -84.93 -26.62 27.11 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.011 0.924 . . . . 0.0 110.318 -179.3 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.65 13.96 69.27 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-N 114.373 -1.285 . . . . 0.0 114.81 176.137 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -113.98 150.02 34.46 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-N 117.415 0.607 . . . . 0.0 110.45 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.21 101.32 7.03 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.697 -1.138 . . . . 0.0 108.697 174.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 75.7 mt -94.92 -177.28 4.11 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.813 0.845 . . . . 0.0 110.58 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.611 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 9.7 p -111.81 168.25 9.73 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 173.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 26.4 t90 -65.04 -32.14 73.72 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 122.745 0.418 . . . . 0.0 111.197 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.611 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 44.2 t -59.43 -46.36 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 C-N-CA 123.681 0.792 . . . . 0.0 110.909 177.446 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 83.2 m -79.41 -19.2 50.6 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.895 0.478 . . . . 0.0 111.348 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.532 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -71.36 -49.44 42.26 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.188 0.595 . . . . 0.0 110.618 177.245 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -77.31 -18.42 57.51 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.28 0.632 . . . . 0.0 111.187 177.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 35.8 t . . . . . 0 C--N 1.355 0.826 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 173.304 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.467 0 CA-C-O 121.107 0.48 . . . . 0.0 109.964 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 17.9 ptp -161.85 142.27 10.47 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.184 0.994 . . . . 0.0 109.949 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 17.4 m -127.96 150.17 72.85 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.039 1.336 . . . . 0.0 109.868 179.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -74.32 140.81 27.97 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 122.504 2.136 . . . . 0.0 112.383 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.476 HD21 ' HB2' ' A' ' 102' ' ' PHE . 74.8 mt . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 N--CA 1.47 0.53 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -129.34 135.27 48.52 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.75 0.42 . . . . 0.0 111.597 -172.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.9 t -73.16 102.05 3.49 Favored 'General case' 0 C--N 1.349 0.586 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 174.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.31 -20.26 62.72 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.165 0.986 . . . . 0.0 113.135 -174.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 16.0 t -67.09 -40.8 86.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 123.527 0.731 . . . . 0.0 111.252 -178.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' HIS . . . . . 0.493 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 2.4 m-70 -103.49 -38.78 7.02 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 121.051 0.453 . . . . 0.0 109.951 -176.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.1 56.32 1.84 Allowed Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.162 -172.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.493 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 5.8 pt-20 -142.09 161.09 38.88 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.786 1.235 . . . . 0.0 109.531 -178.519 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -72.68 140.56 47.96 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 pp -114.08 140.21 48.67 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.35 0.66 . . . . 0.0 110.234 -177.633 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -142.37 95.27 2.77 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 164.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.51 HD11 ' SD ' ' A' ' 125' ' ' MET . 2.5 tm? -169.11 148.28 4.0 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.326 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.41 ' N ' HD13 ' A' ' 101' ' ' LEU . 81.0 t80 -132.94 119.11 19.72 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.285 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.9 t -79.13 108.26 12.5 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 172.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.572 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 29.5 mt-10 -75.75 -34.82 60.31 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.66 0.384 . . . . 0.0 110.423 -178.093 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -69.47 -22.82 63.6 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.843 -178.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -111.22 -30.78 7.31 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.61 0.764 . . . . 0.0 110.673 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.48 48.35 10.82 Favored Glycine 0 C--N 1.336 0.539 0 CA-C-N 115.328 -0.851 . . . . 0.0 113.86 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -141.45 146.52 36.61 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.558 0.743 . . . . 0.0 110.857 175.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.416 ' HB1' HD11 ' A' ' 128' ' ' LEU . . . -81.18 107.3 13.85 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.847 0.859 . . . . 0.0 110.83 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.406 ' HB2' HD12 ' A' ' 101' ' ' LEU . 94.0 mt -102.54 -176.26 3.05 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.825 0.85 . . . . 0.0 110.591 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 4.5 p -108.5 159.23 16.86 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 172.706 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 62.6 t90 -52.38 -39.56 60.99 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.435 0.694 . . . . 0.0 111.937 175.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.594 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 48.2 t -57.91 -52.1 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 123.139 0.576 . . . . 0.0 111.509 179.063 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 88.9 m -72.92 -19.01 61.34 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 122.568 0.347 . . . . 0.0 111.655 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.408 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -72.19 -57.34 4.32 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 122.841 0.456 . . . . 0.0 110.386 176.56 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 21.3 mm-40 -74.37 -30.1 61.84 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.46 -173.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 30.8 t . . . . . 0 N--CA 1.469 0.512 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 168.039 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.572 ' HB1' ' HB2' ' A' ' 104' ' ' GLU . . . . . . . . 0 C--O 1.241 0.624 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.51 ' SD ' HD11 ' A' ' 101' ' ' LEU . 5.7 mmt -137.51 121.3 17.52 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.067 0.947 . . . . 0.0 109.472 -175.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.01 141.36 41.51 Favored Pre-proline 0 N--CA 1.489 1.508 0 C-N-CA 123.562 0.745 . . . . 0.0 109.955 176.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -70.23 150.81 65.88 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.457 2.105 . . . . 0.0 112.008 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.416 HD11 ' HB1' ' A' ' 109' ' ' ALA . 95.9 mt . . . . . 0 N--CA 1.475 0.776 0 CA-C-O 121.156 0.503 . . . . 0.0 109.772 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.473 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 11.1 p -73.7 90.04 1.81 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.202 1.001 . . . . 0.0 110.789 -174.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -64.62 101.97 0.52 Allowed 'General case' 0 C--N 1.354 0.776 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 124.42 104.82 1.6 Allowed Glycine 0 C--N 1.343 0.939 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 -173.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -86.43 99.51 11.69 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.516 0.726 . . . . 0.0 109.372 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -87.99 155.82 19.63 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.925 0.89 . . . . 0.0 110.224 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.55 100.63 3.94 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 170.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.49 -28.23 66.83 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.934 0.894 . . . . 0.0 112.371 -170.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 86.0 t -59.26 -43.37 89.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 123.565 0.746 . . . . 0.0 111.515 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -98.01 -37.81 9.62 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 121.125 0.488 . . . . 0.0 110.443 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.56 49.45 2.75 Favored Glycine 0 C--N 1.343 0.921 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.265 -174.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -138.48 161.64 36.51 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.338 0.655 . . . . 0.0 110.651 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -68.04 137.42 55.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.067 0.947 . . . . 0.0 109.159 170.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.3 pp -111.33 138.34 47.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.629 0.372 . . . . 0.0 110.991 -176.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.47 ' HA ' HD12 ' A' ' 128' ' ' LEU . 76.8 m-70 -141.11 96.61 3.03 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.586 0.754 . . . . 0.0 109.169 167.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.622 ' HA ' ' HA ' ' A' ' 127' ' ' PRO . 3.1 tm? -170.28 141.39 2.03 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 170.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -125.9 111.51 14.89 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 174.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' CYS . . . . . 0.465 ' SG ' HD12 ' A' ' 110' ' ' LEU . 75.0 m -73.72 112.31 9.7 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 168.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.408 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 27.6 mt-10 -74.13 -37.7 64.01 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 13.5 ptmm? -63.08 -46.98 84.85 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.859 177.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.539 ' HB3' ' HD3' ' A' ' 108' ' ' LYS . 6.9 m-20 -84.61 -28.98 26.13 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.33 0.652 . . . . 0.0 110.648 178.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.57 43.74 91.5 Favored Glycine 0 C--N 1.343 0.953 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.447 -172.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.539 ' HD3' ' HB3' ' A' ' 106' ' ' ASP . 58.4 mtpt -134.33 157.62 45.9 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.818 1.247 . . . . 0.0 109.865 -174.088 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -103.08 107.9 18.87 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.205 0.602 . . . . 0.0 110.047 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.465 HD12 ' SG ' ' A' ' 103' ' ' CYS . 68.8 mt -107.81 -175.55 2.81 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.896 0.878 . . . . 0.0 110.329 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.451 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 19.6 p -110.43 176.67 4.95 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.015 0.526 . . . . 0.0 110.117 173.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' TRP . . . . . 0.467 ' O ' ' HG2' ' A' ' 116' ' ' GLN . 51.7 t90 -56.99 -42.4 80.21 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.916 0.76 . . . . 0.0 110.87 173.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.451 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 43.8 t -61.05 -36.45 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 123.558 0.743 . . . . 0.0 111.461 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.456 ' HB2' ' HB3' ' A' ' 110' ' ' LEU . 89.5 m -78.14 -21.82 49.71 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.863 176.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.586 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -72.77 -34.92 67.28 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 170.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 112' ' ' TRP . 12.9 mm100 -79.55 -7.47 58.51 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.325 1.05 . . . . 0.0 111.451 177.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t -64.77 134.4 54.07 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 123.237 0.615 . . . . 0.0 110.839 -178.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 11.3 ptp85 -66.61 -17.14 64.67 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.09 0.956 . . . . 0.0 110.965 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -68.1 -61.07 2.03 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.175 0.99 . . . . 0.0 111.505 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 15.5 m170 -81.57 111.94 18.34 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.55 -162.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -65.1 103.19 0.72 Allowed 'General case' 0 C--N 1.353 0.727 0 C-N-CA 123.939 0.896 . . . . 0.0 110.927 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -64.78 117.33 7.35 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 124.477 1.111 . . . . 0.0 111.205 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 -159.15 -81.2 0.05 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 174.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.454 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . -93.25 72.97 4.58 Favored 'General case' 0 C--N 1.35 0.611 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.457 ' HB3' HD11 ' A' ' 101' ' ' LEU . 23.7 mtm -144.2 119.01 9.88 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.2 m -121.49 137.71 27.33 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 123.929 0.892 . . . . 0.0 109.44 175.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.622 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 32.5 Cg_endo -61.9 155.26 56.01 Favored 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.425 2.083 . . . . 0.0 112.993 177.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.47 HD12 ' HA ' ' A' ' 100' ' ' HIS . 96.7 mt -75.28 93.24 2.84 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.404 0.682 . . . . 0.0 110.276 -177.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -97.78 22.79 8.67 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.985 0.914 . . . . 0.0 112.052 -170.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 . . . . . 0 CA--C 1.546 0.821 0 C-N-CA 123.533 0.733 . . . . 0.0 109.219 -178.251 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.302 0 N-CA-C 113.865 0.306 . . . . 0.0 113.865 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.1 t -146.94 139.22 24.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.366 1.066 . . . . 0.0 108.368 175.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -142.13 12.66 2.01 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.3 1.04 . . . . 0.0 110.423 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -58.88 129.37 49.55 Favored Glycine 0 C--N 1.353 1.481 0 CA-C-O 119.446 -0.641 . . . . 0.0 111.84 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -69.68 93.51 0.72 Allowed 'General case' 0 C--N 1.35 0.619 0 CA-C-O 121.806 0.812 . . . . 0.0 110.586 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -107.79 153.16 23.38 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 113.85 -1.523 . . . . 0.0 109.206 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.8 t -61.82 102.36 0.26 Allowed 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.4 -19.66 64.87 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.291 1.036 . . . . 0.0 113.228 -170.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 19.6 t -66.79 -40.8 86.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.443 0.697 . . . . 0.0 111.124 -178.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.434 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.5 m-70 -104.12 -38.22 7.01 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -177.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.35 37.08 5.2 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-N 114.802 -1.09 . . . . 0.0 112.356 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 1.6 pp20? -132.38 153.76 50.46 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.593 0.757 . . . . 0.0 109.969 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -66.1 133.31 50.46 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.692 0.797 . . . . 0.0 111.101 -173.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.5 pp -98.97 146.38 26.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.499 0.72 . . . . 0.0 110.041 -174.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -145.96 93.27 2.31 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 164.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.544 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -171.42 138.84 1.21 Allowed 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 173.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -125.84 115.91 20.72 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' CYS . . . . . 0.609 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 30.5 t -84.54 127.05 33.83 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -71.87 -45.54 60.96 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.779 0.832 . . . . 0.0 110.985 -175.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -69.61 -32.06 70.56 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.042 0.537 . . . . 0.0 111.273 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.609 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 29.4 t70 -94.08 -27.42 16.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.249 1.019 . . . . 0.0 110.818 -171.03 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.33 34.42 89.87 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-N 115.421 -0.809 . . . . 0.0 113.643 178.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -140.09 162.21 35.77 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.174 0.99 . . . . 0.0 110.084 -175.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -95.96 102.4 14.19 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.747 0.819 . . . . 0.0 110.808 -175.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.497 ' HB2' HD12 ' A' ' 101' ' ' LEU . 74.3 mt -91.54 -176.65 4.57 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.217 1.007 . . . . 0.0 110.499 176.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.4 p -116.29 172.94 6.87 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.15 0.58 . . . . 0.0 110.212 174.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 23.3 t90 -59.41 -47.04 86.98 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.906 0.882 . . . . 0.0 111.781 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 39.8 t -57.86 -39.89 73.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 123.561 0.538 . . . . 0.0 110.821 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 99.0 m -79.28 -26.84 42.29 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.106 0.562 . . . . 0.0 111.632 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.544 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -68.02 -37.09 80.99 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.043 0.537 . . . . 0.0 111.118 177.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -106.42 9.16 31.81 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.18 0.592 . . . . 0.0 111.584 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 44.0 t -59.98 143.48 51.62 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.057 0.543 . . . . 0.0 110.248 179.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -66.43 -7.09 17.14 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.431 0.692 . . . . 0.0 112.328 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -74.02 -35.5 64.37 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.348 0.659 . . . . 0.0 111.147 175.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -141.65 -170.73 3.17 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.099 0.96 . . . . 0.0 110.347 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -139.94 -179.94 6.25 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.737 0.815 . . . . 0.0 109.23 171.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.738 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 9.4 p-10 -90.81 128.67 36.8 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.381 0.673 . . . . 0.0 110.034 176.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 -152.71 -81.41 0.09 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.847 0.859 . . . . 0.0 109.324 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -86.51 74.74 9.85 Favored 'General case' 0 C--N 1.353 0.738 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 177.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.738 ' SD ' ' HA ' ' A' ' 122' ' ' ASP . 2.0 ptm -169.78 129.66 0.99 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.017 -175.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.4 m -107.25 149.99 39.4 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 124.724 1.21 . . . . 0.0 109.412 174.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -76.24 140.52 22.24 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 122.432 2.088 . . . . 0.0 112.55 176.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 73.4 mt -79.14 91.97 5.0 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 173.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -105.88 79.31 1.41 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 175.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 . . . . . 0 CA--C 1.549 0.938 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.99 -174.239 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.587 0 N-CA-C 109.79 -1.324 . . . . 0.0 109.79 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.7 p -99.6 -154.45 0.47 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.486 1.114 . . . . 0.0 109.01 171.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.53 18.22 3.43 Favored 'General case' 0 CA--C 1.563 1.476 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 170.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 63.92 43.81 96.96 Favored Glycine 0 C--N 1.354 1.577 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -169.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -66.92 109.45 2.95 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 124.694 1.198 . . . . 0.0 111.444 -168.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 85.0 mtt85 -120.37 151.05 39.8 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 114.271 -1.332 . . . . 0.0 110.198 -175.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -65.69 101.66 0.65 Allowed 'General case' 0 C--N 1.348 0.54 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.06 -29.12 67.08 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.821 0.848 . . . . 0.0 112.984 -171.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 47.4 t -57.14 -42.5 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 123.816 0.847 . . . . 0.0 111.756 -177.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -104.68 -35.07 7.93 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 -176.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.07 -3.3 55.37 Favored Glycine 0 N--CA 1.476 1.303 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.387 -175.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -83.44 164.31 19.99 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.077 0.951 . . . . 0.0 111.071 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.451 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 41.3 ttp180 -64.5 150.95 45.65 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.065 0.946 . . . . 0.0 110.429 173.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -117.37 141.37 48.4 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.829 0.452 . . . . 0.0 110.275 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 15.9 m80 -149.24 93.83 2.14 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 166.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.499 HD12 ' HB2' ' A' ' 110' ' ' LEU . 3.0 tm? -170.43 143.67 2.33 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 170.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -131.2 104.38 7.03 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 176.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 42.0 t -86.03 118.84 25.75 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -76.55 -39.68 52.08 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.225 0.61 . . . . 0.0 111.407 -174.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 122' ' ' ASP . 0.0 OUTLIER -67.16 -38.65 85.82 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.926 0.491 . . . . 0.0 111.34 177.752 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -81.51 -29.15 33.71 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.184 0.594 . . . . 0.0 110.129 177.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.2 36.1 92.44 Favored Glycine 0 C--N 1.343 0.96 0 CA-C-N 114.815 -1.084 . . . . 0.0 113.398 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -132.22 145.72 51.52 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 124.212 1.005 . . . . 0.0 109.903 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.72 99.74 9.1 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 171.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.499 ' HB2' HD12 ' A' ' 101' ' ' LEU . 83.9 mt -94.76 -176.75 3.97 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.855 0.862 . . . . 0.0 110.533 -178.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.496 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 7.0 p -113.54 164.49 13.57 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 172.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -59.42 -36.21 75.43 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.708 0.803 . . . . 0.0 111.702 178.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.496 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 84.6 t -60.43 -46.03 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 123.233 0.613 . . . . 0.0 111.135 178.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.6 m -78.63 -18.11 54.98 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.692 0.397 . . . . 0.0 111.253 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.33 -41.08 57.6 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.282 0.633 . . . . 0.0 110.201 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -78.76 -17.28 56.05 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.619 0.768 . . . . 0.0 110.803 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.5 t -68.22 113.74 6.11 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -75.2 76.03 2.34 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 122.174 0.987 . . . . 0.0 109.725 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -74.31 -56.92 4.32 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 114.614 -1.176 . . . . 0.0 109.953 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -138.37 -80.2 0.34 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 177.69 121.23 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.318 1.047 . . . . 0.0 108.949 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 33.3 t70 -88.44 152.69 21.72 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.169 0.509 . . . . 0.0 110.392 175.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 48.6 m80 -133.92 -12.81 2.54 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.745 1.218 . . . . 0.0 110.065 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -168.57 99.17 0.41 Allowed 'General case' 0 C--N 1.361 1.101 0 C-N-CA 123.792 0.837 . . . . 0.0 110.387 -176.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 15.4 ptp -132.74 124.41 28.07 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.425 0.69 . . . . 0.0 109.148 167.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.3 m -104.33 136.85 19.12 Favored Pre-proline 0 CA--C 1.552 1.058 0 C-N-CA 123.731 0.813 . . . . 0.0 109.698 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.27 129.86 16.64 Favored 'Trans proline' 0 C--N 1.372 1.787 0 C-N-CA 122.596 2.197 . . . . 0.0 112.206 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 88.7 mt -78.2 121.61 24.59 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -136.95 136.79 38.88 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.053 0.941 . . . . 0.0 108.53 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 . . . . . 0 CA--C 1.553 1.073 0 C-N-CA 123.011 0.525 . . . . 0.0 109.605 -179.927 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.482 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 45.0 p -107.23 113.21 26.48 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.327 0.651 . . . . 0.0 110.569 -177.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -107.22 7.67 29.54 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.885 0.874 . . . . 0.0 110.613 175.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.14 175.31 49.89 Favored Glycine 0 C--N 1.347 1.161 0 O-C-N 123.156 0.285 . . . . 0.0 112.518 -176.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -79.38 74.87 5.99 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.509 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 82.7 mtp180 -125.61 132.87 52.42 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.849 -175.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -65.89 100.48 0.57 Allowed 'General case' 0 C--N 1.355 0.841 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 176.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.53 -24.61 63.82 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.784 0.834 . . . . 0.0 112.475 -173.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.09 -39.98 87.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 124.268 1.027 . . . . 0.0 111.789 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.479 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 1.9 m-70 -105.51 -31.86 8.78 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.18 -10.66 58.36 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-N 115.12 -0.945 . . . . 0.0 112.539 -175.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.479 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 9.4 pt-20 -73.62 179.34 4.18 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-N 117.429 0.615 . . . . 0.0 110.31 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.509 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 33.5 mtp-105 -69.54 -178.98 1.56 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.689 0.795 . . . . 0.0 111.899 172.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 pp -150.93 145.35 25.55 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.977 173.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 12.7 m170 -152.84 92.95 1.7 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 164.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' A' ' 110' ' ' LEU . 2.6 tm? -170.45 146.76 2.87 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.464 ' N ' HD13 ' A' ' 101' ' ' LEU . 60.2 t80 -140.36 108.53 5.77 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.311 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' CYS . . . . . 0.658 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 43.6 t -79.77 143.02 34.83 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -76.97 -39.98 48.57 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.281 0.632 . . . . 0.0 111.638 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -79.55 -46.42 17.37 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.436 0.294 . . . . 0.0 111.392 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.658 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 32.1 t70 -66.16 -31.74 72.77 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.173 0.589 . . . . 0.0 109.916 178.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.28 16.18 62.17 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.044 -0.98 . . . . 0.0 114.39 173.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -128.22 168.5 15.37 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.744 0.818 . . . . 0.0 109.257 -178.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -83.64 104.44 13.76 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.957 -1.019 . . . . 0.0 110.474 -177.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.526 ' HB2' HD12 ' A' ' 101' ' ' LEU . 82.9 mt -91.22 -179.01 5.31 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.7 0.8 . . . . 0.0 110.656 174.339 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.547 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 8.8 p -117.92 162.77 17.59 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 171.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -59.9 -33.89 72.45 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.72 0.808 . . . . 0.0 112.112 178.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.547 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 57.7 t -58.91 -44.0 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 C-N-CA 123.36 0.664 . . . . 0.0 110.786 175.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.452 ' HB3' ' NE2' ' A' ' 120' ' ' HIS . 74.0 m -74.46 -29.06 61.31 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.465 0.706 . . . . 0.0 111.018 177.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.435 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -67.51 -35.21 78.68 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.965 0.506 . . . . 0.0 111.241 178.117 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -78.03 -26.96 48.71 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.406 0.682 . . . . 0.0 111.111 177.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.9 t -61.48 117.54 5.85 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 123.286 0.634 . . . . 0.0 110.934 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.709 ' HA ' ' HB2' ' A' ' 121' ' ' ARG . 97.2 mtt180 -65.38 -16.82 64.0 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.792 0.837 . . . . 0.0 111.794 178.477 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -49.04 -49.15 42.62 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.755 1.222 . . . . 0.0 111.442 173.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.452 ' NE2' ' HB3' ' A' ' 114' ' ' CYS . 15.2 p-80 -134.8 50.49 2.16 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-O 122.054 0.93 . . . . 0.0 109.018 177.376 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.709 ' HB2' ' HA ' ' A' ' 118' ' ' ARG . 36.6 ttt180 -60.7 122.5 14.91 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.401 177.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -146.52 149.24 33.23 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.232 0.539 . . . . 0.0 110.478 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -103.77 -25.32 13.15 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.162 1.385 . . . . 0.0 109.492 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -80.38 72.08 7.23 Favored 'General case' 0 C--N 1.354 0.769 0 CA-C-O 121.933 0.873 . . . . 0.0 109.586 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.1 ptp -148.23 156.47 42.6 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.096 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 31.4 m -125.9 147.07 57.62 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 124.644 1.177 . . . . 0.0 109.67 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.7 128.71 10.35 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 122.203 1.936 . . . . 0.0 112.069 174.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 57.6 mt -76.93 95.02 4.03 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 174.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -164.88 105.87 0.81 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 . . . . . 0 N--CA 1.478 0.954 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 -178.928 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.425 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.4 t -157.0 136.38 12.1 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 123.896 0.878 . . . . 0.0 109.146 173.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -79.1 -75.02 0.26 Allowed 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 177.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 125.5 150.13 7.65 Favored Glycine 0 C--N 1.343 0.95 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 -175.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -89.55 90.93 8.48 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.895 0.878 . . . . 0.0 109.8 -177.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.408 ' HG3' ' HA ' ' A' ' 98' ' ' ARG . 0.0 OUTLIER -122.83 138.34 54.67 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.46 0.704 . . . . 0.0 111.078 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.8 t -67.5 101.35 0.97 Allowed 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 169.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.08 -14.59 60.86 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -167.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 77.9 t -68.34 -46.03 81.48 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 123.059 0.544 . . . . 0.0 111.032 175.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -99.42 -39.54 8.32 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.005 0.431 . . . . 0.0 110.664 -174.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.62 2.52 53.08 Favored Glycine 0 CA--C 1.534 1.25 0 CA-C-N 115.4 -0.818 . . . . 0.0 113.16 -172.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -82.05 152.49 26.6 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 117.307 0.554 . . . . 0.0 109.702 177.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.408 ' HA ' ' HG3' ' A' ' 91' ' ' ARG . 54.1 ttp180 -70.09 119.71 14.69 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 123.561 0.744 . . . . 0.0 109.13 174.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -76.49 136.46 39.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -177.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.3 m80 -154.0 93.82 1.68 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.804 0.841 . . . . 0.0 109.234 172.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.474 HD13 ' N ' ' A' ' 102' ' ' PHE . 3.1 tm? -171.44 150.03 2.79 Favored 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 170.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.474 ' N ' HD13 ' A' ' 101' ' ' LEU . 61.2 t80 -138.68 110.94 7.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' CYS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 48.6 t -84.19 139.64 32.26 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -73.33 -53.65 10.28 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 122.723 0.409 . . . . 0.0 110.665 -174.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.97 -34.88 78.99 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.454 0.702 . . . . 0.0 112.513 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.456 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 30.3 t0 -82.83 -33.02 27.26 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 -177.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.36 25.71 67.1 Favored Glycine 0 C--N 1.351 1.397 0 CA-C-N 115.349 -0.842 . . . . 0.0 113.631 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -120.25 150.3 40.9 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.132 0.973 . . . . 0.0 109.901 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.26 100.52 11.27 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.149 176.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 28.4 mt -90.93 -178.24 5.16 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.344 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.6 p -112.76 178.08 4.41 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 46.8 t90 -63.41 -51.11 67.17 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.401 0.438 . . . . 0.0 111.872 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 97.5 t -61.7 -45.89 97.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 C-N-CA 123.287 0.635 . . . . 0.0 112.175 -174.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 96.7 m -68.99 -25.3 64.45 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 122.738 0.415 . . . . 0.0 111.838 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.96 -51.74 6.9 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 123.113 0.565 . . . . 0.0 111.227 -175.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -81.3 -10.85 59.49 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.734 -172.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 33.5 t -74.77 94.93 2.81 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 161.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -65.77 103.93 0.98 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.971 0.908 . . . . 0.0 112.114 -164.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -122.94 -158.59 0.8 Allowed 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.923 1.289 . . . . 0.0 108.461 172.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 9.5 p-80 -73.56 55.57 0.5 Allowed 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 124.918 1.287 . . . . 0.0 112.114 176.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 81.7 mmt-85 -144.9 -36.73 0.3 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.368 1.467 . . . . 0.0 108.478 -178.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.648 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 16.3 t70 -74.19 82.31 1.82 Allowed 'General case' 0 C--N 1.356 0.88 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.348 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -146.28 -65.91 0.29 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -132.09 117.58 18.52 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 174.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.648 ' SD ' ' HA ' ' A' ' 122' ' ' ASP . 15.4 ptm -163.29 117.62 1.63 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.794 0.838 . . . . 0.0 109.409 -170.46 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 30.2 m -92.05 135.36 27.28 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 122.955 0.502 . . . . 0.0 109.995 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.26 120.65 6.07 Favored 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 122.26 1.974 . . . . 0.0 111.671 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 98.7 mt -70.27 115.87 9.97 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 169.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -125.74 98.81 5.71 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -176.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 . . . . . 0 CA--C 1.548 0.876 0 N-CA-C 108.831 -0.804 . . . . 0.0 108.831 179.557 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.582 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.417 ' HB ' ' HB2' ' A' ' 91' ' ' ARG . 66.6 p -68.58 103.56 1.73 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.413 0.685 . . . . 0.0 109.576 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -70.23 104.17 2.57 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.541 0.736 . . . . 0.0 110.615 -171.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.01 173.7 22.68 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.555 -172.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.67 90.96 0.78 Allowed 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.591 ' HG2' ' HD2' ' A' ' 98' ' ' ARG . 69.4 mtt180 -127.69 136.44 51.58 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.913 0.885 . . . . 0.0 109.922 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.1 t -72.71 100.41 2.82 Favored 'General case' 0 C--N 1.354 0.792 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 175.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.78 -30.12 71.25 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.877 0.871 . . . . 0.0 111.861 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 67.8 t -52.46 -40.5 32.82 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 124.961 1.305 . . . . 0.0 112.314 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -103.99 -37.84 7.21 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.46 24.33 18.94 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 114.953 -1.022 . . . . 0.0 111.815 -171.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -103.33 178.72 4.47 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.591 ' HD2' ' HG2' ' A' ' 91' ' ' ARG . 4.7 tpt180 -74.93 166.26 23.94 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 123.759 0.824 . . . . 0.0 109.953 173.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.5 pp -133.6 134.7 43.59 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.526 -0.734 . . . . 0.0 110.594 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.592 ' HA ' HD12 ' A' ' 128' ' ' LEU . 78.7 m-70 -142.17 95.45 2.8 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 166.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.556 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -171.95 154.81 3.61 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 170.433 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.401 ' N ' HD13 ' A' ' 101' ' ' LEU . 87.9 t80 -135.4 116.09 13.9 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 28.8 t -85.65 124.18 31.9 Favored 'General case' 0 C--N 1.346 0.416 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -73.71 -44.93 55.08 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.408 0.683 . . . . 0.0 110.969 -173.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.3 -40.65 58.35 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.644 -178.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -78.2 -31.91 49.69 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.253 0.621 . . . . 0.0 110.067 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.18 -19.61 25.82 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.619 -0.719 . . . . 0.0 114.538 174.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -88.24 144.13 26.62 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 117.712 0.756 . . . . 0.0 111.45 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.423 ' HB1' HD11 ' A' ' 128' ' ' LEU . . . -73.4 114.81 12.03 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.738 174.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.48 ' HB2' HD12 ' A' ' 101' ' ' LEU . 82.9 mt -98.93 179.19 4.71 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.74 0.816 . . . . 0.0 110.706 -178.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 8.2 p -99.61 164.1 12.21 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 168.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 63.1 t90 -62.62 -36.01 81.41 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 123.42 0.45 . . . . 0.0 111.325 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 85.0 t -59.77 -40.56 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 C-N-CA 123.256 0.623 . . . . 0.0 111.357 176.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 66.8 m -74.68 -20.81 59.72 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.793 0.437 . . . . 0.0 111.157 177.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.556 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -74.85 -44.0 51.46 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.269 0.628 . . . . 0.0 110.968 176.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -96.24 5.71 50.42 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.983 0.913 . . . . 0.0 111.759 -176.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t -58.24 135.92 57.21 Favored 'General case' 0 C--O 1.245 0.84 0 C-N-CA 123.682 0.793 . . . . 0.0 110.99 -176.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -71.9 87.78 1.02 Allowed 'General case' 0 CA--C 1.543 0.708 0 O-C-N 123.995 0.809 . . . . 0.0 109.052 -177.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -152.08 -55.4 0.13 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.02 1.328 . . . . 0.0 108.059 -170.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -164.63 164.4 21.51 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.173 -1.376 . . . . 0.0 109.253 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -73.18 153.12 40.83 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.288 0.635 . . . . 0.0 110.126 177.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -62.84 125.95 25.68 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 175.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -99.08 -60.32 1.56 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -174.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -145.08 100.98 3.56 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 124.166 0.986 . . . . 0.0 108.915 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 17.6 ptp -155.26 135.4 13.06 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.593 0.757 . . . . 0.0 110.888 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.9 m -114.36 149.98 43.02 Favored Pre-proline 0 N--CA 1.479 0.99 0 C-N-CA 124.665 1.186 . . . . 0.0 108.893 171.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.89 152.19 77.4 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.295 1.997 . . . . 0.0 111.89 173.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.592 HD12 ' HA ' ' A' ' 100' ' ' HIS . 63.8 mt -72.1 87.27 1.07 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 170.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -135.89 90.18 2.56 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.673 0.789 . . . . 0.0 108.908 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 . . . . . 0 CA--C 1.551 0.982 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.291 -176.589 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.987 0 CA-C-O 120.713 0.063 . . . . 0.0 112.956 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.8 p -67.63 -18.94 65.15 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.419 1.088 . . . . 0.0 113.226 -176.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -85.37 -21.29 28.93 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.122 0.569 . . . . 0.0 112.283 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.97 -113.53 4.04 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.426 -0.652 . . . . 0.0 112.592 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -66.83 113.86 5.23 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 46.3 mtm180 -132.69 136.4 46.41 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.777 0.831 . . . . 0.0 111.003 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -74.51 106.42 6.1 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 173.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.68 -17.67 64.12 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -172.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.5 t -67.88 -35.15 71.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.007 0.523 . . . . 0.0 111.359 178.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -107.29 -37.62 6.2 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.196 0.522 . . . . 0.0 109.805 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.18 29.64 12.26 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.058 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -104.72 168.38 9.11 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.281 1.032 . . . . 0.0 109.717 176.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -72.99 124.31 25.22 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 167.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.2 pp -75.91 138.46 41.05 Favored 'General case' 0 C--N 1.357 0.923 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.84 94.29 2.15 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.123 0.569 . . . . 0.0 109.531 173.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.549 HD11 ' HB2' ' A' ' 125' ' ' MET . 2.4 tm? -172.24 143.38 1.47 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 105.827 -1.916 . . . . 0.0 105.827 170.21 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.431 ' N ' HD13 ' A' ' 101' ' ' LEU . 73.9 t80 -127.61 113.62 16.32 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 175.264 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' CYS . . . . . 0.535 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 48.8 t -83.29 129.75 35.02 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -178.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -75.01 -41.42 59.42 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.422 0.689 . . . . 0.0 111.452 -175.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -39.57 63.8 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 120.901 0.382 . . . . 0.0 111.113 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.535 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 26.4 t70 -80.6 -30.34 36.83 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.924 0.89 . . . . 0.0 110.687 -178.001 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.02 8.57 64.86 Favored Glycine 0 C--N 1.343 0.937 0 CA-C-N 115.552 -0.749 . . . . 0.0 114.449 176.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -116.92 -179.71 3.77 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.606 0.763 . . . . 0.0 109.925 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -103.01 109.86 21.56 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.613 0.765 . . . . 0.0 112.084 -172.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.7 mt -93.3 -175.58 3.87 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.857 0.863 . . . . 0.0 110.427 173.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.558 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 0.7 OUTLIER -111.84 149.51 31.7 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 164.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -60.33 -28.45 68.16 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.933 0.493 . . . . 0.0 112.006 -176.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.558 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 71.2 t -61.96 -42.06 93.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.388 0.675 . . . . 0.0 111.277 175.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 89.8 m -75.81 -17.61 59.79 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.009 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.409 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -77.7 -36.88 50.66 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.988 0.515 . . . . 0.0 110.58 169.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -84.57 -3.89 58.69 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.538 0.735 . . . . 0.0 111.414 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 46.9 t -73.16 152.81 40.98 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.641 0.777 . . . . 0.0 109.435 169.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -75.99 -26.23 56.54 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 173.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -61.28 101.03 0.14 Allowed 'General case' 0 C--N 1.357 0.904 0 C-N-CA 123.956 0.902 . . . . 0.0 111.372 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 20.5 m80 61.98 29.38 17.73 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.428 1.091 . . . . 0.0 112.15 167.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 25.6 ptt180 -61.81 125.49 24.03 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.578 0.751 . . . . 0.0 111.178 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.428 ' HB2' ' SD ' ' A' ' 125' ' ' MET . 38.3 m-20 -92.69 -174.26 3.59 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.122 -173.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 37.0 t-80 -110.88 -60.11 1.87 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -80.85 89.68 5.85 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.264 177.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.549 ' HB2' HD11 ' A' ' 101' ' ' LEU . 8.2 ptm -155.27 112.33 3.29 Favored 'General case' 0 CA--C 1.555 1.146 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.407 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 34.3 m -96.85 138.63 21.34 Favored Pre-proline 0 N--CA 1.491 1.618 0 C-N-CA 123.502 0.721 . . . . 0.0 111.38 -175.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.434 ' HA ' HD22 ' A' ' 101' ' ' LEU . 58.2 Cg_endo -70.26 123.55 10.04 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.784 2.323 . . . . 0.0 114.312 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 82.7 mt -72.28 122.8 21.73 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 167.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -135.29 68.56 1.46 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.729 0.812 . . . . 0.0 109.5 178.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 . . . . . 0 CA--C 1.556 1.199 0 C-N-CA 123.842 0.857 . . . . 0.0 109.622 178.836 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.701 0 N-CA-C 112.277 -0.329 . . . . 0.0 112.277 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 36.3 p -67.52 -48.08 68.07 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.368 0.667 . . . . 0.0 110.618 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -95.02 112.09 23.83 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 171.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 153.46 105.86 0.27 Allowed Glycine 0 C--N 1.342 0.877 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.22 68.18 2.59 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 122.266 1.032 . . . . 0.0 108.719 173.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.508 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 54.2 mtt180 -134.6 136.9 43.26 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.347 -169.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 2.4 t -70.16 99.97 1.58 Allowed 'General case' 0 C--N 1.35 0.595 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 174.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.83 -20.77 65.2 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.451 0.7 . . . . 0.0 112.55 -170.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 50.8 t -63.26 -47.5 91.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 124.042 0.937 . . . . 0.0 111.042 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.506 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 0.8 OUTLIER -93.81 -28.2 16.02 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.727 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.53 27.82 31.54 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.115 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.506 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 9.8 pt-20 -110.27 169.93 8.42 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.835 1.254 . . . . 0.0 108.748 173.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.508 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 45.3 mtm105 -67.89 168.76 11.04 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 121.327 0.584 . . . . 0.0 110.523 168.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -124.72 136.74 54.14 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.99 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.517 ' HA ' HD12 ' A' ' 128' ' ' LEU . 75.2 m-70 -143.89 94.02 2.53 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 167.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.778 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 1.8 tm? -171.59 151.56 2.98 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.872 1.669 . . . . 0.0 106.52 171.6 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.517 ' N ' HD13 ' A' ' 101' ' ' LEU . 38.9 t80 -141.54 124.95 16.59 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 73.4 m -82.3 123.24 28.89 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.163 0.585 . . . . 0.0 109.991 175.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.632 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 10.9 mm-40 -74.88 -30.06 61.19 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 121.286 0.565 . . . . 0.0 111.416 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -89.78 -38.85 13.51 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.659 -176.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -89.72 -31.33 17.51 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.434 0.694 . . . . 0.0 110.743 -178.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.82 41.39 49.69 Favored Glycine 0 C--N 1.342 0.867 0 CA-C-N 115.741 -0.663 . . . . 0.0 113.779 177.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -133.05 144.43 50.02 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.461 0.704 . . . . 0.0 110.777 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.27 100.75 11.43 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.306 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 66.9 mt -92.02 -177.41 4.69 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.448 0.699 . . . . 0.0 110.322 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 5.6 p -103.35 165.79 10.82 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 168.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 49.6 t90 -64.71 -29.85 70.85 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.213 0.605 . . . . 0.0 111.724 -179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.35 -39.68 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 122.839 0.456 . . . . 0.0 110.756 177.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 96.9 m -76.05 -17.09 59.8 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.021 0.529 . . . . 0.0 111.426 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.778 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -75.52 -49.1 19.73 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.213 0.605 . . . . 0.0 110.94 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -85.48 -28.23 25.15 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.441 -173.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 29.4 t -77.74 92.9 4.22 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 166.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -95.3 77.51 3.43 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.531 -166.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -71.2 -61.03 1.92 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.025 -0.989 . . . . 0.0 109.436 175.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 2.4 p-80 -165.84 110.54 0.84 Allowed 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.84 0.856 . . . . 0.0 110.526 172.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.549 ' HG2' ' SD ' ' A' ' 125' ' ' MET . 2.7 tpm_? -157.27 -55.72 0.08 Allowed 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 172.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 73.82 107.57 0.07 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 125.436 1.494 . . . . 0.0 114.047 167.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 70.6 t60 84.54 -70.64 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 125.18 1.392 . . . . 0.0 113.518 157.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.632 ' HB1' ' HB2' ' A' ' 104' ' ' GLU . . . -76.16 76.17 2.99 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 121.623 0.725 . . . . 0.0 112.119 -170.195 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.549 ' SD ' ' HG2' ' A' ' 121' ' ' ARG . 52.7 mmm -127.07 112.38 15.13 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.788 1.235 . . . . 0.0 108.097 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 33.2 m -116.37 151.39 46.83 Favored Pre-proline 0 N--CA 1.493 1.707 0 C-N-CA 123.47 0.708 . . . . 0.0 110.575 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -78.97 137.81 14.11 Favored 'Trans proline' 0 C--N 1.375 1.925 0 C-N-CA 122.719 2.28 . . . . 0.0 113.122 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 100' ' ' HIS . 60.7 mt -71.66 97.05 1.66 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 171.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -136.97 46.24 2.2 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-O 122.567 1.175 . . . . 0.0 108.618 -174.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.8 mp0 . . . . . 0 CA--C 1.551 1.014 0 CA-C-N 114.561 -1.199 . . . . 0.0 108.831 176.695 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.117 0 CA-C-O 120.355 -0.136 . . . . 0.0 113.295 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 47.5 m -71.89 102.16 2.83 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 170.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -59.93 123.7 17.89 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.048 0.939 . . . . 0.0 110.594 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -72.97 -96.77 0.08 OUTLIER Glycine 0 C--N 1.341 0.819 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.333 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 58.45 21.13 8.13 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 124.959 1.304 . . . . 0.0 111.805 -177.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -126.39 128.52 47.17 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.837 0.855 . . . . 0.0 109.313 -178.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.4 t -68.59 100.64 1.15 Allowed 'General case' 0 C--N 1.349 0.573 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 174.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.06 -19.82 63.32 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.995 0.918 . . . . 0.0 112.496 -175.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.2 t -62.81 -38.68 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.096 0 C-N-CA 124.173 0.989 . . . . 0.0 111.434 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.431 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 2.1 m-70 -108.09 -39.27 5.55 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 120.88 0.371 . . . . 0.0 110.094 -177.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.42 52.3 2.37 Favored Glycine 0 C--N 1.347 1.166 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.138 -170.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.431 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.0 OUTLIER -146.69 161.21 41.07 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.501 1.12 . . . . 0.0 108.774 176.922 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 60.5 ttt85 -73.6 139.74 45.74 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.335 0.654 . . . . 0.0 110.995 -178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -105.44 137.16 43.72 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.216 1.007 . . . . 0.0 110.397 -176.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -141.02 93.29 2.57 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 165.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.523 HD11 ' HB3' ' A' ' 125' ' ' MET . 1.6 tm? -172.07 155.7 3.8 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 170.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.519 ' N ' HD13 ' A' ' 101' ' ' LEU . 33.0 t80 -153.5 121.55 6.11 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 171.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' CYS . . . . . 0.638 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 46.4 t -96.02 130.65 42.97 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 176.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -67.05 -47.9 69.92 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.612 0.765 . . . . 0.0 110.903 -175.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -75.96 -35.58 59.61 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -177.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.638 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 10.1 t70 -70.69 -33.11 70.55 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 176.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.42 30.85 78.82 Favored Glycine 0 C--N 1.342 0.902 0 CA-C-N 114.875 -1.057 . . . . 0.0 114.55 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -130.25 149.59 51.88 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.484 0.714 . . . . 0.0 109.585 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.98 100.27 9.6 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.652 -0.869 . . . . 0.0 108.652 174.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 75.5 mt -88.46 176.12 7.31 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.312 -176.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.467 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 12.6 p -115.28 173.13 6.67 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 172.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -59.21 -40.38 85.59 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 123.227 0.329 . . . . 0.0 111.358 176.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.467 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 59.2 t -61.65 -43.5 97.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.494 0.718 . . . . 0.0 111.484 -178.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.1 m -78.72 -18.22 54.64 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.442 0.297 . . . . 0.0 111.282 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.428 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -76.91 -43.94 33.69 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.412 0.685 . . . . 0.0 110.677 176.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -77.53 -16.92 58.4 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.337 0.655 . . . . 0.0 110.59 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 19.5 t -68.25 95.75 0.61 Allowed 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 172.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -72.31 88.79 1.18 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.217 1.007 . . . . 0.0 110.223 -175.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -121.96 -82.29 0.65 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.185 0.594 . . . . 0.0 111.19 -171.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -166.7 161.46 15.68 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.702 1.201 . . . . 0.0 109.8 -167.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 17.9 mtp180 65.56 25.39 11.73 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 124.353 1.033 . . . . 0.0 111.192 177.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -89.46 87.47 7.09 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.932 0.893 . . . . 0.0 110.218 -175.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -163.42 142.67 8.35 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.172 0.589 . . . . 0.0 110.709 173.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 54.35 58.07 5.28 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.712 1.205 . . . . 0.0 110.6 -177.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.523 ' HB3' HD11 ' A' ' 101' ' ' LEU . 90.0 mtp -101.74 106.46 17.47 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 21.1 m -104.77 149.37 37.42 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 124.281 1.032 . . . . 0.0 109.924 -177.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.01 151.4 50.11 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 122.097 1.864 . . . . 0.0 111.092 172.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 45.7 mt -78.43 84.77 4.57 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 121.478 0.656 . . . . 0.0 110.503 177.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -137.58 93.03 2.75 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.688 173.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 . . . . . 0 N--CA 1.478 0.968 0 C-N-CA 123.881 0.872 . . . . 0.0 110.06 -173.435 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.609 0 N-CA-C 111.89 -0.484 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 32.8 p -78.5 80.69 4.87 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-O 121.624 0.726 . . . . 0.0 109.781 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -84.29 155.79 22.24 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.981 -176.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 168.09 -177.69 42.15 Favored Glycine 0 C--N 1.338 0.669 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.326 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.27 32.74 1.9 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.201 1.0 . . . . 0.0 110.913 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -123.51 138.47 54.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.433 0.693 . . . . 0.0 110.739 -176.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.2 t -69.45 102.62 1.83 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.697 0.799 . . . . 0.0 108.967 174.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.8 -8.32 47.22 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.971 0.908 . . . . 0.0 113.148 -173.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 55.0 t -75.07 -38.92 43.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 C-N-CA 123.385 0.674 . . . . 0.0 111.042 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -106.67 -37.25 6.48 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 -176.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.89 32.8 6.64 Favored Glycine 0 N--CA 1.474 1.201 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.092 -173.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -118.74 167.01 12.08 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.608 1.163 . . . . 0.0 109.282 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -71.7 144.32 49.36 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.306 0.643 . . . . 0.0 109.45 172.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -106.33 136.82 45.39 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -144.49 95.4 2.7 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 167.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.452 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.9 tm? -170.35 146.69 2.91 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 170.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.447 ' HB2' HD21 ' A' ' 128' ' ' LEU . 39.1 t80 -140.16 112.96 8.09 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 69.7 m -66.81 115.46 6.62 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.656 0.783 . . . . 0.0 110.231 173.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -69.24 -29.77 67.76 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.014 0.525 . . . . 0.0 111.537 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -84.12 -48.27 10.03 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.139 0.576 . . . . 0.0 111.42 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.91 -16.85 29.13 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.218 0.607 . . . . 0.0 111.073 -170.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.63 35.07 89.34 Favored Glycine 0 C--N 1.347 1.163 0 C-N-CA 123.573 0.606 . . . . 0.0 114.456 175.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -129.45 149.41 51.24 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.634 0.774 . . . . 0.0 110.48 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -95.28 103.05 14.9 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.453 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.6 mt -94.36 -179.3 4.87 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.516 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 10.6 p -111.43 173.81 6.17 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 171.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 32.2 t90 -59.07 -42.14 89.68 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.159 0.584 . . . . 0.0 111.5 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.75 -41.49 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.212 0 C-N-CA 123.565 0.746 . . . . 0.0 111.714 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 85.3 m -78.52 -14.05 59.54 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 122.58 0.352 . . . . 0.0 111.147 177.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.452 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -80.67 -49.27 11.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.255 0.622 . . . . 0.0 110.475 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -75.52 -16.94 60.23 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.008 0.923 . . . . 0.0 112.002 -173.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.2 p -71.5 -170.75 0.55 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.427 0.691 . . . . 0.0 111.789 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 20.0 tpp85 -68.89 79.16 0.31 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.74 0.816 . . . . 0.0 110.948 -178.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -140.06 -178.56 5.51 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.362 1.465 . . . . 0.0 109.535 -175.955 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 123' ' ' HIS . 17.1 p-80 -65.98 78.96 0.08 Allowed 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 124.26 1.024 . . . . 0.0 110.673 175.157 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 13.0 mmm180 -64.59 103.25 0.65 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.689 0.796 . . . . 0.0 112.003 -171.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 66.96 24.78 9.52 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.112 1.365 . . . . 0.0 111.442 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 77.4 m80 -107.17 96.5 6.47 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.975 0.91 . . . . 0.0 109.229 176.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 57.43 68.84 0.8 Allowed 'General case' 0 C--O 1.246 0.879 0 C-N-CA 124.577 1.151 . . . . 0.0 111.99 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 21.3 ptm -157.63 116.0 3.15 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.357 -176.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.4 m -103.65 150.03 37.7 Favored Pre-proline 0 N--CA 1.483 1.205 0 C-N-CA 123.843 0.857 . . . . 0.0 110.31 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -80.52 139.6 12.87 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 122.163 1.909 . . . . 0.0 111.698 174.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.447 HD21 ' HB2' ' A' ' 102' ' ' PHE . 74.9 mt -76.07 105.36 7.07 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 120.977 0.417 . . . . 0.0 110.087 178.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -131.82 74.59 1.6 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.445 1.098 . . . . 0.0 109.231 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 . . . . . 0 CA--C 1.554 1.103 0 CA-C-N 114.717 -1.129 . . . . 0.0 110.633 179.25 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.502 0 N-CA-C 111.554 -0.618 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.6 p -89.75 8.89 29.46 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.194 0.998 . . . . 0.0 111.698 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -64.41 96.15 0.15 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.053 0.941 . . . . 0.0 110.581 177.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.89 99.28 0.68 Allowed Glycine 0 C--N 1.345 1.049 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.578 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -65.97 94.08 0.22 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.783 0.833 . . . . 0.0 110.222 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 65.8 mtm180 -132.28 134.86 45.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.593 1.157 . . . . 0.0 109.578 -175.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -69.09 101.78 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 171.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.51 -7.16 48.61 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.58 0.752 . . . . 0.0 112.603 -172.177 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -67.25 -50.93 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 123.484 0.714 . . . . 0.0 110.221 174.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -95.06 -36.99 11.31 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.655 -176.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.48 42.62 4.18 Favored Glycine 0 C--N 1.347 1.149 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.029 -175.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -126.45 156.63 40.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.155 0.982 . . . . 0.0 109.648 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -67.53 128.62 37.12 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.875 0.87 . . . . 0.0 109.771 172.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 pp -97.51 143.56 28.09 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 122.945 0.498 . . . . 0.0 110.565 -178.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -147.55 96.09 2.63 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 164.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.5 tm? -170.26 151.8 3.95 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 106.164 -1.791 . . . . 0.0 106.164 169.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.469 ' N ' HD13 ' A' ' 101' ' ' LEU . 32.7 t80 -137.15 115.84 12.12 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 175.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' CYS . . . . . 0.637 ' HB3' ' HB2' ' A' ' 106' ' ' ASP . 6.4 t -78.59 134.84 37.17 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.569 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 13.9 mm-40 -77.26 -40.14 45.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.774 0.43 . . . . 0.0 111.113 177.406 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -74.68 -42.01 59.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.674 0.389 . . . . 0.0 111.181 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.637 ' HB2' ' HB3' ' A' ' 103' ' ' CYS . 1.9 m-20 -81.3 -25.22 36.66 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.999 0.92 . . . . 0.0 110.958 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.23 25.14 69.51 Favored Glycine 0 C--N 1.355 1.611 0 O-C-N 123.383 0.427 . . . . 0.0 113.84 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -132.5 153.98 50.38 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.265 0.626 . . . . 0.0 110.705 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.66 103.41 7.58 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.822 0.849 . . . . 0.0 110.666 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 84.1 mt -94.43 -177.78 4.36 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.109 0.964 . . . . 0.0 110.861 176.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.49 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 4.7 p -112.12 162.59 15.26 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -53.02 -40.43 63.87 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.362 0.665 . . . . 0.0 112.401 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.49 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 62.1 t -60.6 -44.41 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 C-N-CA 123.676 0.79 . . . . 0.0 111.266 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.8 m -79.86 -19.45 48.3 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 122.586 0.354 . . . . 0.0 111.739 177.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.534 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -71.18 -53.73 13.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.359 0.664 . . . . 0.0 110.987 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -75.65 -14.6 60.37 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.257 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.8 t -66.59 110.81 3.33 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 123.662 0.785 . . . . 0.0 109.126 174.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -74.46 84.55 1.99 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.515 0.726 . . . . 0.0 110.133 -176.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -84.45 -49.83 8.3 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.585 1.154 . . . . 0.0 109.369 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -132.92 -158.66 0.9 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.534 1.534 . . . . 0.0 107.842 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -77.06 67.13 3.0 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 169.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -75.28 120.27 20.53 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.714 0.806 . . . . 0.0 109.938 -176.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -160.55 -51.42 0.05 OUTLIER 'General case' 0 C--O 1.24 0.576 0 C-N-CA 123.71 0.804 . . . . 0.0 109.44 -172.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.569 ' HB1' ' HB2' ' A' ' 104' ' ' GLU . . . -70.44 93.4 0.88 Allowed 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.43 175.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.3 ptp -159.18 151.13 20.81 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.141 0.977 . . . . 0.0 109.755 176.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 34.7 m -125.62 142.18 41.22 Favored Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 124.37 1.068 . . . . 0.0 109.336 176.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -73.65 126.11 10.57 Favored 'Trans proline' 0 C--N 1.373 1.867 0 C-N-CA 122.037 1.825 . . . . 0.0 111.981 176.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 49.0 mt -72.26 96.4 1.83 Allowed 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -123.04 139.46 54.06 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 173.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 123.593 0.757 . . . . 0.0 109.294 -177.56 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.89 0 CA-C-O 119.757 -0.468 . . . . 0.0 112.331 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.6 m 49.75 71.62 0.38 Allowed 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 125.189 1.395 . . . . 0.0 111.083 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -158.06 -177.41 6.54 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.268 -170.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.86 -130.38 9.67 Favored Glycine 0 C--N 1.347 1.186 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.643 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -142.94 42.8 1.57 Allowed 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 122.175 0.988 . . . . 0.0 109.969 -178.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.424 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 94.0 mtt180 -120.57 138.23 53.99 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 114.66 -1.155 . . . . 0.0 109.679 173.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -68.98 102.18 1.54 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 173.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.29 -20.52 62.99 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -169.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.5 t -67.24 -47.08 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.226 0.611 . . . . 0.0 111.13 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.547 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.0 OUTLIER -93.62 -38.66 11.23 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -177.079 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.69 36.92 6.64 Favored Glycine 0 C--N 1.35 1.357 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.889 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.547 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.4 OUTLIER -127.86 166.2 18.71 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.059 0.944 . . . . 0.0 109.97 176.453 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.424 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 2.9 tpt180 -71.17 124.87 25.44 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.217 1.007 . . . . 0.0 110.869 -173.432 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.8 pp -89.19 131.62 35.23 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 178.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -149.96 96.76 2.49 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.259 1.024 . . . . 0.0 108.612 165.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.536 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 3.1 tm? -168.74 149.76 4.64 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 174.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -139.17 118.01 12.4 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' CYS . . . . . 0.59 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 42.4 t -84.44 123.74 30.57 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 172.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -62.32 -46.93 86.53 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.864 0.865 . . . . 0.0 112.868 -169.322 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -87.84 -29.84 20.63 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -177.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.59 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 27.2 t70 -72.81 -32.86 65.84 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-O 121.049 0.452 . . . . 0.0 110.586 178.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.46 18.59 73.72 Favored Glycine 0 C--N 1.34 0.783 0 CA-C-N 115.274 -0.875 . . . . 0.0 115.214 173.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -112.53 153.07 28.06 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 117.825 0.813 . . . . 0.0 110.032 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.48 101.03 13.52 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.792 -1.094 . . . . 0.0 108.416 178.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.495 ' HB2' HD12 ' A' ' 101' ' ' LEU . 27.8 mt -91.8 -176.97 4.62 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.096 0.959 . . . . 0.0 109.554 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.628 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 2.9 p -111.19 158.82 18.49 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 171.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -60.9 -33.62 73.4 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.413 0.685 . . . . 0.0 110.997 178.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.628 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 60.4 t -58.55 -43.04 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 C-N-CA 123.585 0.754 . . . . 0.0 111.331 177.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 69.1 m -72.74 -29.87 63.69 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.728 177.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.536 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -68.56 -48.02 65.34 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.276 0.63 . . . . 0.0 111.244 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -78.03 -9.31 59.06 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.579 0.752 . . . . 0.0 112.018 -176.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 39.1 t -56.6 134.36 54.38 Favored 'General case' 0 C--O 1.247 0.948 0 C-N-CA 123.475 0.71 . . . . 0.0 109.894 174.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -64.78 115.5 5.36 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 124.288 0.992 . . . . 0.0 110.743 -172.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -109.81 165.95 11.3 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.419 1.088 . . . . 0.0 112.346 -174.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -63.36 -35.68 81.19 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 113.316 -1.765 . . . . 0.0 110.762 166.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -156.01 143.07 19.04 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 123.711 0.804 . . . . 0.0 109.798 -175.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -70.65 140.74 51.63 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.462 0.705 . . . . 0.0 109.43 170.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -126.0 161.8 26.72 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.336 0.654 . . . . 0.0 110.698 -174.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.98 98.08 1.55 Allowed 'General case' 0 C--N 1.347 0.468 0 C-N-CA 124.111 0.964 . . . . 0.0 110.503 -177.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.6 ptp -141.73 132.42 25.59 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.499 178.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.5 m -112.13 144.46 30.81 Favored Pre-proline 0 N--CA 1.481 1.119 0 C-N-CA 124.999 1.32 . . . . 0.0 109.9 177.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.64 147.08 50.49 Favored 'Trans proline' 0 C--N 1.375 1.922 0 C-N-CA 122.538 2.159 . . . . 0.0 112.258 178.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 69.9 mt -78.72 92.31 4.77 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.142 0.577 . . . . 0.0 109.824 177.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -104.35 40.64 1.43 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.347 1.059 . . . . 0.0 109.04 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? . . . . . 0 CA--C 1.553 1.08 0 C-N-CA 124.045 0.938 . . . . 0.0 111.699 -175.201 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.691 0 N-CA-C 111.741 -0.543 . . . . 0.0 111.741 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 39.5 m -65.59 104.73 1.07 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 123.588 0.755 . . . . 0.0 109.402 177.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 58.75 76.81 0.33 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.624 1.169 . . . . 0.0 109.365 -170.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -77.84 66.17 3.11 Favored Glycine 0 C--N 1.35 1.324 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.669 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -92.73 27.93 2.2 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.867 1.267 . . . . 0.0 110.007 177.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -128.3 127.88 43.58 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.905 0.882 . . . . 0.0 109.918 -177.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -68.86 103.29 1.75 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.63 -23.5 51.49 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -168.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 46.3 t -59.8 -44.98 95.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.528 0.731 . . . . 0.0 111.549 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -104.84 -38.75 6.54 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -172.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.09 -6.46 58.24 Favored Glycine 0 C--N 1.349 1.252 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.533 -170.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -67.46 165.0 17.56 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.946 0.898 . . . . 0.0 110.205 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.91 132.68 43.79 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 170.405 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 pp -92.66 129.58 38.55 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 178.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -147.96 95.01 2.42 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 171.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.475 HD11 ' HB3' ' A' ' 125' ' ' MET . 2.9 tm? -171.14 121.32 0.53 Allowed 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 173.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -96.62 111.39 23.55 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 172.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 38.2 t -87.31 108.34 18.92 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -73.64 -19.97 60.7 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -174.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.557 ' HE3' ' SD ' ' A' ' 125' ' ' MET . 21.5 pttp -84.89 -36.43 21.5 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.253 0.621 . . . . 0.0 111.038 177.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -87.69 -26.9 22.74 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.297 0.639 . . . . 0.0 110.048 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.93 17.41 71.54 Favored Glycine 0 C--N 1.343 0.933 0 CA-C-N 115.015 -0.993 . . . . 0.0 113.804 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 108' ' ' LYS . 0.0 OUTLIER -122.71 170.31 10.18 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 123.733 0.813 . . . . 0.0 110.181 -179.243 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.43 108.15 20.07 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.124 -173.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.1 mt -100.9 -177.2 3.39 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.711 1.204 . . . . 0.0 111.334 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.0 p -112.9 161.57 16.83 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 43.2 t90 -54.66 -44.15 73.01 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.025 0.93 . . . . 0.0 112.038 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.6 t -60.45 -41.0 85.96 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.661 0.785 . . . . 0.0 111.586 -176.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 97.1 m -75.37 -26.1 58.22 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.653 0.381 . . . . 0.0 111.594 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.65 -36.0 62.85 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.19 0.596 . . . . 0.0 111.001 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -94.92 -2.66 50.14 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.602 0.761 . . . . 0.0 111.715 -178.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t -68.42 -175.09 0.6 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.66 0.784 . . . . 0.0 111.41 -178.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 24.6 mmt180 -65.81 -4.42 6.62 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.049 0.94 . . . . 0.0 112.054 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -54.66 -70.68 0.1 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.993 1.317 . . . . 0.0 111.906 174.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 18.6 p-80 -172.9 -177.99 1.74 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.376 1.07 . . . . 0.0 109.97 -169.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -99.85 149.69 23.13 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.306 0.642 . . . . 0.0 109.724 171.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.745 ' HB2' ' HB2' ' A' ' 125' ' ' MET . 10.0 p-10 -82.76 107.4 15.35 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.541 0.737 . . . . 0.0 109.449 171.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -95.38 -62.89 1.22 Allowed 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 175.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -115.59 58.92 0.72 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.745 ' HB2' ' HB2' ' A' ' 122' ' ' ASP . 72.8 mtp -129.33 107.24 9.37 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 178.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 33.9 m -91.22 161.69 34.3 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.06 0.944 . . . . 0.0 110.006 -173.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -76.11 167.75 25.38 Favored 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 122.173 1.915 . . . . 0.0 112.28 174.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 15.5 mt -112.51 114.02 26.48 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.64 0.776 . . . . 0.0 111.411 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -141.35 56.62 1.53 Allowed 'General case' 0 C--O 1.241 0.646 0 C-N-CA 124.55 1.14 . . . . 0.0 108.142 169.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.55 0.954 0 CA-C-N 114.391 -1.277 . . . . 0.0 108.744 -178.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.255 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.5 t -133.56 14.49 4.07 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.102 0.961 . . . . 0.0 110.077 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -70.64 -17.9 62.86 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.026 0.931 . . . . 0.0 112.237 177.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 171.87 -179.01 43.82 Favored Glycine 0 C--N 1.343 0.933 0 N-CA-C 112.147 -0.381 . . . . 0.0 112.147 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.417 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -90.43 40.91 1.03 Allowed 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.186 0.994 . . . . 0.0 110.66 -177.682 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 84.9 mtt85 -110.04 132.38 54.22 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.578 -0.701 . . . . 0.0 110.638 -178.078 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -62.47 103.06 0.37 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.965 1.306 . . . . 0.0 109.517 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.02 -15.7 35.01 Favored 'General case' 0 N--CA 1.486 1.333 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -166.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 97.8 t -74.61 -43.97 47.38 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 123.16 0.584 . . . . 0.0 111.335 177.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -100.28 -39.91 7.79 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.222 0.534 . . . . 0.0 110.603 -173.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.05 -10.71 60.29 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.555 -168.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -74.28 145.78 43.72 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.632 0.773 . . . . 0.0 109.856 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 58.3 ttp180 -62.5 144.19 56.3 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.663 0.785 . . . . 0.0 110.894 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 2.7 pp -109.48 141.75 41.48 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 123.635 0.774 . . . . 0.0 110.498 -175.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -148.61 94.46 2.28 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 164.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.459 HD21 ' SD ' ' A' ' 125' ' ' MET . 1.5 tp -170.01 158.55 7.18 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.082 1.353 . . . . 0.0 108.363 172.211 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.414 ' N ' ' HG ' ' A' ' 101' ' ' LEU . 67.4 t80 -138.05 109.79 7.11 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.831 0.852 . . . . 0.0 109.892 177.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 97.4 m -65.61 110.89 2.91 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.737 0.815 . . . . 0.0 108.966 168.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -76.13 -32.55 59.18 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.876 0.87 . . . . 0.0 110.919 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.537 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 15.2 ptmm? -81.58 -11.94 58.95 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.487 -176.301 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -131.32 -27.82 1.95 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.614 0.366 . . . . 0.0 111.036 -172.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.96 40.34 21.44 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 116.084 -0.507 . . . . 0.0 113.592 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -120.02 153.61 35.78 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.822 0.849 . . . . 0.0 110.253 179.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.97 106.97 17.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.245 0.618 . . . . 0.0 109.729 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.7 mt -107.14 -175.74 2.88 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.469 0.707 . . . . 0.0 109.832 178.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.574 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 19.9 p -105.4 167.02 10.02 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 171.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 65.9 t90 -56.56 -36.27 69.13 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 124.236 1.015 . . . . 0.0 111.798 173.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.574 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 60.1 t -59.53 -37.53 70.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 123.479 0.712 . . . . 0.0 111.385 176.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 59.4 m -72.78 -23.32 60.79 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.894 0.478 . . . . 0.0 110.993 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.473 ' O ' ' HA ' ' A' ' 121' ' ' ARG . . . -87.9 -1.94 58.3 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.599 0.76 . . . . 0.0 111.717 173.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -120.22 12.82 11.88 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.358 0.663 . . . . 0.0 110.398 173.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 42.9 t -69.9 166.1 20.24 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 124.33 1.052 . . . . 0.0 111.916 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 12.1 tpp180 -62.5 -36.74 83.51 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.016 173.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -86.22 -45.49 11.26 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.486 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -123.7 135.87 54.12 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 122.73 0.412 . . . . 0.0 111.721 -172.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.473 ' HA ' ' O ' ' A' ' 115' ' ' ALA . 53.2 ttm-85 -146.46 -79.28 0.16 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.503 0.721 . . . . 0.0 111.002 176.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -103.35 37.87 1.9 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.143 0.977 . . . . 0.0 111.435 -166.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 76.3 m-70 -84.88 176.16 8.66 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.537 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . -67.26 89.81 0.21 Allowed 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.063 0.459 . . . . 0.0 109.881 177.181 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.459 ' SD ' HD21 ' A' ' 101' ' ' LEU . 15.0 ptp -156.03 129.71 8.42 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 124.36 1.064 . . . . 0.0 109.255 -178.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.4 m -106.29 134.33 19.83 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 123.559 0.744 . . . . 0.0 109.895 175.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.85 120.32 7.24 Favored 'Trans proline' 0 C--N 1.368 1.589 0 C-N-CA 122.309 2.006 . . . . 0.0 110.625 174.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.5 mt -73.12 84.98 1.34 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.54 100.27 5.09 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 -178.669 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 . . . . . 0 CA--C 1.557 1.225 0 C-N-CA 123.778 0.831 . . . . 0.0 109.855 -169.474 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.884 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.2 p -68.1 -24.58 65.05 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.127 0.971 . . . . 0.0 112.976 -173.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -71.39 91.41 1.01 Allowed 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 175.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -103.39 82.76 0.4 Allowed Glycine 0 C--N 1.346 1.095 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.166 -175.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.21 25.16 0.74 Allowed 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 123.992 0.917 . . . . 0.0 110.584 172.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -122.4 134.09 54.62 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 125.749 1.62 . . . . 0.0 108.652 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.445 ' HB2' ' HB3' ' A' ' 111' ' ' CYS . 18.8 t -64.61 103.26 0.65 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.0 -19.32 12.14 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -169.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.4 t -69.17 -51.29 44.86 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 123.368 0.667 . . . . 0.0 111.13 179.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -95.39 -38.4 10.51 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.008 0.432 . . . . 0.0 110.14 -173.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.16 17.79 36.05 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.413 -0.812 . . . . 0.0 113.759 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.425 ' OE2' ' HB3' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -105.4 166.72 10.23 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 117.676 0.738 . . . . 0.0 110.012 174.055 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -68.71 123.99 22.43 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.513 1.125 . . . . 0.0 110.633 -175.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.1 pp -90.7 131.07 36.6 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.495 0.718 . . . . 0.0 109.125 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -143.84 93.77 2.5 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 165.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.641 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -170.11 150.81 3.8 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 170.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.454 ' N ' HD13 ' A' ' 101' ' ' LEU . 84.1 t80 -144.52 110.43 5.39 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 176.427 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 43.9 t -86.28 112.85 21.78 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 178.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -73.6 -31.37 63.54 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.098 0.959 . . . . 0.0 111.596 -176.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.83 -45.13 21.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.854 0.462 . . . . 0.0 111.111 177.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -79.89 -22.93 42.22 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.622 0.769 . . . . 0.0 109.985 -177.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.72 40.57 93.92 Favored Glycine 0 C--N 1.344 1.027 0 C-N-CA 123.905 0.764 . . . . 0.0 114.146 177.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -132.69 138.78 47.39 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.658 0.783 . . . . 0.0 110.61 177.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.04 100.21 8.06 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 169.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.554 ' HB2' HD12 ' A' ' 101' ' ' LEU . 83.7 mt -95.28 -178.47 4.46 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.67 0.788 . . . . 0.0 111.02 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.456 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 13.7 p -110.74 173.06 6.51 Favored 'General case' 0 C--O 1.244 0.792 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 172.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -59.34 -38.7 81.03 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.158 0.583 . . . . 0.0 111.617 175.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.456 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 41.7 t -62.72 -43.04 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 C-N-CA 123.529 0.731 . . . . 0.0 111.101 -178.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.8 m -78.71 -15.54 58.34 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.072 0.549 . . . . 0.0 111.45 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.641 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -78.74 -33.27 46.75 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.38 0.672 . . . . 0.0 110.331 173.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -80.57 -27.16 37.54 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.722 0.809 . . . . 0.0 110.274 175.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 48.0 t -68.81 110.72 4.49 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 50.4 mtp180 -90.64 38.69 0.95 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.257 1.023 . . . . 0.0 110.008 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -56.76 -42.51 79.5 Favored 'General case' 0 C--N 1.357 0.901 0 C-N-CA 124.996 1.318 . . . . 0.0 111.555 -177.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -115.87 -74.01 0.63 Allowed 'General case' 0 C--O 1.24 0.572 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -172.6 165.74 5.52 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.0 0.92 . . . . 0.0 110.207 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -94.81 -145.12 0.26 Allowed 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 124.769 1.228 . . . . 0.0 108.868 174.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 69.9 m80 77.95 140.93 0.07 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 125.616 1.567 . . . . 0.0 111.164 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 47.42 59.94 3.79 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 124.59 1.156 . . . . 0.0 111.815 176.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.52 ' HB3' HD11 ' A' ' 101' ' ' LEU . 20.9 mtm -136.06 109.95 8.18 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.803 0.841 . . . . 0.0 108.976 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 26.8 m -103.8 132.43 21.05 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 123.647 0.779 . . . . 0.0 110.184 177.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.543 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 49.2 Cg_endo -67.32 141.84 58.0 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.303 2.002 . . . . 0.0 111.137 175.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 86.7 mt -75.14 100.6 4.31 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.127 0.489 . . . . 0.0 110.031 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -120.12 67.31 0.83 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 174.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 . . . . . 0 CA--C 1.558 1.283 0 C-N-CA 125.524 1.53 . . . . 0.0 110.16 -178.633 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.784 0 N-CA-C 110.789 -0.924 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.9 m -63.03 93.52 0.06 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.106 0.963 . . . . 0.0 111.868 -172.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.493 ' HB3' ' HB2' ' A' ' 91' ' ' ARG . 78.5 mm-40 -82.9 109.71 17.26 Favored 'General case' 0 C--O 1.242 0.705 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.843 175.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -74.43 -112.14 0.08 OUTLIER Glycine 0 C--N 1.35 1.322 0 N-CA-C 111.925 -0.47 . . . . 0.0 111.925 176.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.472 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 2.3 mp0 -83.54 64.8 8.1 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 168.52 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.522 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 32.8 mtp85 -130.86 131.45 44.57 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.622 0.769 . . . . 0.0 110.056 -173.002 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.5 t -69.46 101.47 1.58 Allowed 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.71 -10.76 55.26 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -169.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 60.8 t -68.73 -51.44 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.54 0.736 . . . . 0.0 110.558 175.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -89.5 -31.84 17.47 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 -178.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.71 -0.37 67.48 Favored Glycine 0 C--N 1.351 1.416 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.123 -175.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -78.55 159.07 28.34 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.915 0.886 . . . . 0.0 111.086 -178.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.522 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 7.9 tpt180 -71.98 132.58 44.49 Favored 'General case' 0 CA--C 1.552 1.02 0 O-C-N 124.011 0.819 . . . . 0.0 109.158 167.667 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 4.1 pp -101.2 148.62 24.88 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 122.932 0.493 . . . . 0.0 110.17 -177.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.428 ' HA ' HD12 ' A' ' 128' ' ' LEU . 66.5 m80 -144.91 94.88 2.6 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 123.945 0.778 . . . . 0.0 109.096 167.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.602 ' HA ' ' HA ' ' A' ' 127' ' ' PRO . 3.2 tm? -170.43 115.4 0.48 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.453 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -95.16 113.17 24.82 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 35.8 t -85.43 112.92 21.31 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -75.87 -32.84 59.89 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.581 0.753 . . . . 0.0 111.612 -174.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 21.2 ptmt -74.62 -39.51 62.09 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.711 0.404 . . . . 0.0 111.177 178.352 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -86.18 -26.59 25.04 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.616 0.766 . . . . 0.0 109.707 -177.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.41 27.19 73.04 Favored Glycine 0 C--N 1.341 0.857 0 C-N-CA 124.126 0.869 . . . . 0.0 113.811 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -131.73 152.99 50.51 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.73 0.812 . . . . 0.0 110.703 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.33 100.24 11.13 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.215 178.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.473 ' HB2' HD12 ' A' ' 101' ' ' LEU . 21.1 mt -89.61 -177.71 5.36 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.761 0.824 . . . . 0.0 109.893 175.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.52 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 1.3 p -112.44 160.72 17.47 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 173.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 47.5 t90 -52.28 -43.3 64.35 Favored 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 124.592 1.157 . . . . 0.0 112.253 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.52 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 95.7 t -59.16 -46.98 91.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 123.55 0.74 . . . . 0.0 111.594 -179.254 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 71.4 m -79.28 -14.76 58.81 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.668 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.481 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -82.16 -39.52 23.1 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.565 0.746 . . . . 0.0 110.65 177.021 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -91.83 14.75 14.59 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.205 0.602 . . . . 0.0 110.673 176.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 47.0 t -74.41 161.78 29.49 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.779 0.832 . . . . 0.0 110.304 169.132 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -61.66 -24.85 67.01 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.536 0.734 . . . . 0.0 111.452 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -63.06 -29.66 70.99 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.425 0.69 . . . . 0.0 112.141 178.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -125.02 161.73 26.09 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.246 0.619 . . . . 0.0 110.995 -176.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -139.61 -75.28 0.36 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.24 1.016 . . . . 0.0 108.934 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -170.95 101.06 0.22 Allowed 'General case' 0 C--O 1.239 0.518 0 N-CA-C 106.363 -1.717 . . . . 0.0 106.363 -177.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -127.75 -61.85 1.1 Allowed 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -168.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.402 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . -175.08 86.27 0.04 OUTLIER 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 177.3 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.544 ' HB2' HD11 ' A' ' 101' ' ' LEU . 9.3 ptm -167.11 110.94 0.71 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.768 0.827 . . . . 0.0 109.959 -169.314 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.6 m -116.26 136.86 23.12 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.839 1.255 . . . . 0.0 110.063 -178.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' PRO . . . . . 0.602 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 28.6 Cg_endo -61.31 142.64 96.68 Favored 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.665 2.243 . . . . 0.0 113.124 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 100' ' ' HIS . 93.2 mt -68.61 108.9 3.53 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.35 0.66 . . . . 0.0 109.503 175.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.14 64.34 8.33 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.4 0.68 . . . . 0.0 110.403 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 . . . . . 0 N--CA 1.475 0.821 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.498 -179.67 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.703 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 34.1 m -61.76 -36.99 82.64 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.647 0.779 . . . . 0.0 110.731 -178.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -87.95 44.73 1.21 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.287 1.035 . . . . 0.0 110.565 175.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.85 91.87 0.23 Allowed Glycine 0 C--N 1.348 1.198 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -68.23 78.44 0.25 Allowed 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.45 1.1 . . . . 0.0 110.505 -176.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.427 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 76.2 mtp180 -124.17 133.88 53.45 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.285 0.634 . . . . 0.0 110.998 -170.438 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.1 t -67.46 100.41 0.85 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 171.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.45 -13.7 62.27 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -168.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 98.8 t -61.93 -43.98 98.25 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 C-N-CA 123.21 0.604 . . . . 0.0 111.25 173.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -104.37 -38.02 6.99 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 121.508 0.671 . . . . 0.0 109.814 -176.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.79 -3.29 52.69 Favored Glycine 0 CA--C 1.532 1.133 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.616 -172.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.55 157.45 33.87 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 118.159 0.98 . . . . 0.0 109.911 177.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.427 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 36.1 ttp-105 -72.43 124.09 24.45 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 173.661 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -83.95 134.84 34.64 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.423 0.689 . . . . 0.0 109.584 -177.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -146.41 94.77 2.5 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 168.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.553 HD11 ' SD ' ' A' ' 125' ' ' MET . 2.4 tm? -171.79 153.46 3.32 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 171.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.467 ' N ' HD13 ' A' ' 101' ' ' LEU . 77.1 t80 -143.81 120.06 10.85 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 173.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' CYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 44.7 t -82.69 125.64 31.46 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.13 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -69.45 -32.4 71.32 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.061 0.944 . . . . 0.0 112.106 -177.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.95 -41.55 11.07 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.716 0.407 . . . . 0.0 111.459 -178.007 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.427 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 37.0 t70 -78.85 -28.43 44.27 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.257 0.623 . . . . 0.0 110.723 -177.36 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.54 35.85 62.71 Favored Glycine 0 C--N 1.351 1.392 0 CA-C-N 116.027 -0.533 . . . . 0.0 114.22 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -133.67 147.09 51.39 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.328 0.651 . . . . 0.0 111.58 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.96 100.51 9.72 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.516 176.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 77.4 mt -100.62 -175.79 3.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.173 0.989 . . . . 0.0 111.008 -176.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.421 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 10.1 p -110.68 170.84 7.82 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 168.063 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 82.9 t90 -57.24 -47.01 82.44 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.807 0.443 . . . . 0.0 111.653 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.421 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 71.1 t -55.28 -47.61 77.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 C-N-CA 123.916 0.886 . . . . 0.0 112.387 -175.726 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 74.4 m -76.68 -19.72 57.42 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.548 0.339 . . . . 0.0 111.554 -178.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.21 -34.37 32.28 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.42 0.629 . . . . 0.0 110.567 177.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -114.45 17.56 17.33 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.252 -170.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 38.7 t -70.81 165.41 23.22 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 123.408 0.683 . . . . 0.0 110.302 175.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -60.57 138.99 57.97 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 80.26 -41.01 0.2 Allowed 'General case' 0 N--CA 1.498 1.959 0 C-N-CA 125.314 1.446 . . . . 0.0 110.912 -175.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -65.31 100.89 0.51 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.662 0.785 . . . . 0.0 109.032 175.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -85.33 157.18 20.61 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.622 0.769 . . . . 0.0 111.278 -171.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.62 102.77 2.34 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.213 0.605 . . . . 0.0 109.768 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 9.9 p-80 -123.63 -158.17 0.79 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.546 1.138 . . . . 0.0 108.604 173.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.64 89.36 0.15 Allowed 'General case' 0 CA--C 1.551 1.004 0 CA-C-O 121.399 0.619 . . . . 0.0 111.136 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.553 ' SD ' HD11 ' A' ' 101' ' ' LEU . 7.0 mmt -121.05 119.78 33.46 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.099 1.36 . . . . 0.0 108.374 177.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 36.0 m -117.7 145.71 37.08 Favored Pre-proline 0 N--CA 1.488 1.451 0 C-N-CA 123.703 0.801 . . . . 0.0 110.826 -176.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -70.66 151.63 64.07 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.869 2.379 . . . . 0.0 113.377 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 87.3 mt -94.39 134.09 37.27 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 168.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.19 165.99 23.81 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.07 0.948 . . . . 0.0 108.78 172.604 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 -175.574 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.394 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.9 t -148.44 -174.56 4.63 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.664 0.786 . . . . 0.0 110.056 -176.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -67.27 -179.9 1.1 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.28 1.032 . . . . 0.0 111.83 176.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -75.63 76.11 1.37 Allowed Glycine 0 C--N 1.348 1.208 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 173.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.516 ' HG3' ' HG3' ' A' ' 91' ' ' ARG . 6.3 pt-20 -84.55 -16.47 42.15 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.028 0.931 . . . . 0.0 111.305 176.311 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.516 ' HG3' ' HG3' ' A' ' 90' ' ' GLU . 60.9 mtt85 -118.96 136.09 54.26 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.476 1.111 . . . . 0.0 108.763 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 8.8 t -69.71 102.0 1.8 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 173.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.73 -20.03 63.06 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -170.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.3 t -62.53 -40.34 87.85 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.299 0 C-N-CA 123.973 0.909 . . . . 0.0 111.651 177.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.49 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.3 m-70 -107.59 -38.23 5.96 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.16 0.505 . . . . 0.0 110.095 -177.291 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.31 25.65 15.85 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.457 -0.792 . . . . 0.0 113.2 -176.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.49 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.0 OUTLIER -113.36 152.49 29.9 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.608 0.763 . . . . 0.0 109.535 174.13 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -70.21 122.94 20.45 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.315 0.646 . . . . 0.0 109.688 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.6 pp -80.97 138.61 36.08 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.985 -171.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -144.79 98.12 3.13 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.547 0.739 . . . . 0.0 109.78 167.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.686 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 1.9 tm? -168.28 143.09 3.48 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 105.243 -2.132 . . . . 0.0 105.243 169.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.407 ' N ' HD13 ' A' ' 101' ' ' LEU . 37.9 t80 -129.69 115.23 17.03 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' CYS . . . . . 0.43 ' SG ' ' HG2' ' A' ' 105' ' ' LYS . 47.5 t -97.02 131.97 43.3 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.378 0.671 . . . . 0.0 109.386 179.018 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -74.3 -52.21 12.94 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.004 0.922 . . . . 0.0 111.121 -178.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.43 ' HG2' ' SG ' ' A' ' 103' ' ' CYS . 14.8 ptmm? -63.07 -38.66 92.07 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.042 0.537 . . . . 0.0 111.06 -176.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -83.66 -29.66 27.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.7 0.8 . . . . 0.0 109.857 -178.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.19 34.71 88.97 Favored Glycine 0 C--N 1.346 1.131 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.518 179.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -132.7 147.35 52.33 Favored 'General case' 0 C--O 1.242 0.67 0 C-N-CA 123.44 0.696 . . . . 0.0 110.738 -172.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.23 99.99 10.91 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 114.333 -1.303 . . . . 0.0 108.341 172.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 59.8 mt -93.9 -177.3 4.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.023 0.929 . . . . 0.0 110.242 179.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.505 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 2.8 p -108.9 159.68 16.61 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 173.334 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -58.85 -33.92 71.0 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.281 0.632 . . . . 0.0 111.765 177.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.505 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 28.6 t -63.69 -43.47 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.312 0 C-N-CA 123.622 0.769 . . . . 0.0 111.021 -179.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 91.5 m -77.73 -17.91 57.09 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 122.936 0.494 . . . . 0.0 111.186 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.686 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -73.52 -40.65 63.87 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 122.844 0.458 . . . . 0.0 110.304 170.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -87.19 -9.94 53.9 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.524 0.73 . . . . 0.0 112.369 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 80.4 p -72.72 108.99 6.01 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 168.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.9 ttt180 -77.42 10.08 2.8 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 122.804 0.442 . . . . 0.0 111.881 -169.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -62.6 -17.49 60.3 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.481 0.713 . . . . 0.0 111.011 163.012 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 46.7 m80 -104.4 -177.35 3.34 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.572 1.149 . . . . 0.0 108.79 174.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 -143.46 140.18 30.24 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 122.913 0.485 . . . . 0.0 109.768 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.84 98.94 0.21 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.321 1.048 . . . . 0.0 110.467 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -141.53 92.82 2.5 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 56.73 61.83 2.5 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.6 1.16 . . . . 0.0 111.321 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 84.0 mtp -122.24 109.1 14.05 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.5 m -108.03 162.71 18.91 Favored Pre-proline 0 N--CA 1.48 1.05 0 C-N-CA 124.488 1.115 . . . . 0.0 109.303 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -66.82 150.35 83.28 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 121.787 1.658 . . . . 0.0 110.877 171.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.468 ' HB2' ' N ' ' A' ' 101' ' ' LEU . 1.7 tt -69.37 97.24 0.95 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -178.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -145.48 130.45 18.28 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.053 0.941 . . . . 0.0 108.474 175.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 . . . . . 0 CA--C 1.553 1.064 0 C-N-CA 123.739 0.816 . . . . 0.0 110.119 179.649 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.097 0 N-CA-C 113.503 0.161 . . . . 0.0 113.503 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.7 t -90.68 -1.72 57.86 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.375 0.67 . . . . 0.0 110.682 175.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 56.4 71.23 0.58 Allowed 'General case' 0 C--N 1.358 0.963 0 C-N-CA 124.62 1.168 . . . . 0.0 109.498 -168.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -77.16 47.51 2.63 Favored Glycine 0 C--N 1.352 1.458 0 CA-C-N 116.014 -0.539 . . . . 0.0 113.103 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -94.67 5.53 51.59 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.77 1.228 . . . . 0.0 109.898 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 59.2 mtm-85 -115.34 135.0 54.59 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.843 1.257 . . . . 0.0 108.796 174.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.409 ' HB3' ' OE2' ' A' ' 97' ' ' GLU . 10.3 t -69.42 102.07 1.7 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 176.171 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -50.66 -30.13 12.82 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.842 1.257 . . . . 0.0 113.906 -172.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.71 -42.87 96.23 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.071 0 C-N-CA 123.421 0.689 . . . . 0.0 112.002 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.9 -37.79 8.09 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 120.997 0.427 . . . . 0.0 110.21 -175.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.91 3.88 54.64 Favored Glycine 0 C--N 1.346 1.108 0 CA-C-N 115.472 -0.786 . . . . 0.0 113.844 178.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.409 ' OE2' ' HB3' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -94.79 166.46 11.97 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-N 117.765 0.782 . . . . 0.0 109.882 177.376 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -73.09 120.91 19.38 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.039 0.535 . . . . 0.0 110.142 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -80.17 136.99 36.61 Favored 'General case' 0 C--N 1.349 0.551 0 C-N-CA 123.711 0.804 . . . . 0.0 109.587 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -145.0 95.01 2.62 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 166.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.532 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.6 tm? -172.16 149.3 2.29 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 168.117 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.476 ' HB2' HD21 ' A' ' 128' ' ' LEU . 79.0 t80 -130.5 114.23 15.24 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 172.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' CYS . . . . . 0.536 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 41.1 t -84.22 120.15 25.87 Favored 'General case' 0 C--O 1.227 -0.103 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 177.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -70.87 -39.59 72.79 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.613 0.765 . . . . 0.0 111.152 -172.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.534 ' HE2' ' HB3' ' A' ' 121' ' ' ARG . 0.0 OUTLIER -76.44 -34.47 58.76 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.224 -178.369 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.536 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 32.6 t70 -84.93 -26.62 27.11 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.011 0.924 . . . . 0.0 110.318 -179.3 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.65 13.96 69.27 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-N 114.373 -1.285 . . . . 0.0 114.81 176.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -113.98 150.02 34.46 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-N 117.415 0.607 . . . . 0.0 110.45 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.21 101.32 7.03 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.697 -1.138 . . . . 0.0 108.697 174.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 75.7 mt -94.92 -177.28 4.11 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.813 0.845 . . . . 0.0 110.58 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.611 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 9.7 p -111.81 168.25 9.73 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 173.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 26.4 t90 -65.04 -32.14 73.72 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 122.745 0.418 . . . . 0.0 111.197 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.611 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 44.2 t -59.43 -46.36 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 C-N-CA 123.681 0.792 . . . . 0.0 110.909 177.446 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 83.2 m -79.41 -19.2 50.6 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.895 0.478 . . . . 0.0 111.348 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.532 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -71.36 -49.44 42.26 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.188 0.595 . . . . 0.0 110.618 177.245 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -77.31 -18.42 57.51 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.28 0.632 . . . . 0.0 111.187 177.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 35.8 t -65.17 142.36 58.36 Favored 'General case' 0 C--N 1.355 0.826 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 173.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -65.79 121.39 14.92 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 123.988 0.805 . . . . 0.0 111.425 -170.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.479 ' HB2' ' HB3' ' A' ' 122' ' ' ASP . 0.0 OUTLIER -113.74 163.18 15.37 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 123.911 0.884 . . . . 0.0 109.948 178.833 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -60.94 -28.57 69.06 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.517 1.127 . . . . 0.0 111.114 175.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.534 ' HB3' ' HE2' ' A' ' 105' ' ' LYS . 28.3 tpt180 -165.94 91.44 0.48 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.546 1.138 . . . . 0.0 108.13 -177.613 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.479 ' HB3' ' HB2' ' A' ' 119' ' ' LYS . 3.5 p-10 -109.09 111.05 22.48 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.354 0.662 . . . . 0.0 110.618 -178.313 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -166.92 -46.88 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.811 0.844 . . . . 0.0 109.813 175.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.88 89.29 1.38 Allowed 'General case' 0 C--N 1.354 0.793 0 C-N-CA 123.637 0.775 . . . . 0.0 109.964 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 17.9 ptp -161.85 142.27 10.47 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.184 0.994 . . . . 0.0 109.949 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 17.4 m -127.96 150.17 72.85 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.039 1.336 . . . . 0.0 109.868 179.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -74.32 140.81 27.97 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 122.504 2.136 . . . . 0.0 112.383 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.476 HD21 ' HB2' ' A' ' 102' ' ' PHE . 74.8 mt -87.9 92.29 9.07 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 174.261 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -114.74 81.18 1.52 Allowed 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 171.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 . . . . . 0 CA--C 1.544 0.736 0 C-N-CA 124.374 1.069 . . . . 0.0 109.833 -172.637 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.548 ' N ' HE22 ' A' ' 88' ' ' GLN . . . . . . . . 0 N--CA 1.47 0.9 0 N-CA-C 111.813 -0.515 . . . . 0.0 111.813 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.8 p -99.42 90.37 4.51 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 121.424 0.63 . . . . 0.0 110.686 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.548 HE22 ' N ' ' A' ' 86' ' ' GLY . 0.0 OUTLIER -156.14 167.18 31.24 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.814 0.846 . . . . 0.0 109.796 177.524 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 73.92 73.18 0.93 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.182 177.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -62.4 122.15 15.0 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 171.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -129.34 135.27 48.52 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.75 0.42 . . . . 0.0 111.597 -172.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.9 t -73.16 102.05 3.49 Favored 'General case' 0 C--N 1.349 0.586 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 174.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.31 -20.26 62.72 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.165 0.986 . . . . 0.0 113.135 -174.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 16.0 t -67.09 -40.8 86.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 123.527 0.731 . . . . 0.0 111.252 -178.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.493 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 2.4 m-70 -103.49 -38.78 7.02 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 121.051 0.453 . . . . 0.0 109.951 -176.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.1 56.32 1.84 Allowed Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.162 -172.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.493 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 5.8 pt-20 -142.09 161.09 38.88 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.786 1.235 . . . . 0.0 109.531 -178.519 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -72.68 140.56 47.96 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 pp -114.08 140.21 48.67 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.35 0.66 . . . . 0.0 110.234 -177.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -142.37 95.27 2.77 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 164.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.51 HD11 ' SD ' ' A' ' 125' ' ' MET . 2.5 tm? -169.11 148.28 4.0 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.326 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.41 ' N ' HD13 ' A' ' 101' ' ' LEU . 81.0 t80 -132.94 119.11 19.72 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.285 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.9 t -79.13 108.26 12.5 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 172.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.572 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 29.5 mt-10 -75.75 -34.82 60.31 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.66 0.384 . . . . 0.0 110.423 -178.093 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -69.47 -22.82 63.6 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.843 -178.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -111.22 -30.78 7.31 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.61 0.764 . . . . 0.0 110.673 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.48 48.35 10.82 Favored Glycine 0 C--N 1.336 0.539 0 CA-C-N 115.328 -0.851 . . . . 0.0 113.86 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -141.45 146.52 36.61 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.558 0.743 . . . . 0.0 110.857 175.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.416 ' HB1' HD11 ' A' ' 128' ' ' LEU . . . -81.18 107.3 13.85 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.847 0.859 . . . . 0.0 110.83 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.406 ' HB2' HD12 ' A' ' 101' ' ' LEU . 94.0 mt -102.54 -176.26 3.05 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.825 0.85 . . . . 0.0 110.591 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 4.5 p -108.5 159.23 16.86 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 172.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 62.6 t90 -52.38 -39.56 60.99 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.435 0.694 . . . . 0.0 111.937 175.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.594 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 48.2 t -57.91 -52.1 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 123.139 0.576 . . . . 0.0 111.509 179.063 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 88.9 m -72.92 -19.01 61.34 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 122.568 0.347 . . . . 0.0 111.655 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.408 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -72.19 -57.34 4.32 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 122.841 0.456 . . . . 0.0 110.386 176.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 21.3 mm-40 -74.37 -30.1 61.84 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.46 -173.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 30.8 t -73.65 94.45 2.19 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 168.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -133.32 147.2 51.86 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 -174.408 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -62.02 -51.03 69.65 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 177.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -104.53 -88.37 0.43 Allowed 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 172.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.589 ' HD3' ' H ' ' A' ' 122' ' ' ASP . 6.3 tpp180 -163.09 151.28 13.82 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.072 0.549 . . . . 0.0 110.497 -178.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.589 ' H ' ' HD3' ' A' ' 121' ' ' ARG . 2.4 m-20 -50.83 149.52 3.4 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.359 1.464 . . . . 0.0 112.379 178.459 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -125.26 -67.16 0.91 Allowed 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.568 0.747 . . . . 0.0 109.805 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.572 ' HB1' ' HB2' ' A' ' 104' ' ' GLU . . . -124.44 92.68 3.71 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -177.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.51 ' SD ' HD11 ' A' ' 101' ' ' LEU . 5.7 mmt -137.51 121.3 17.52 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.067 0.947 . . . . 0.0 109.472 -175.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.01 141.36 41.51 Favored Pre-proline 0 N--CA 1.489 1.508 0 C-N-CA 123.562 0.745 . . . . 0.0 109.955 176.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -70.23 150.81 65.88 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.457 2.105 . . . . 0.0 112.008 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.416 HD11 ' HB1' ' A' ' 109' ' ' ALA . 95.9 mt -80.85 86.0 6.08 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.156 0.503 . . . . 0.0 109.772 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -95.84 52.83 1.36 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.247 1.019 . . . . 0.0 110.656 -176.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 . . . . . 0 CA--C 1.551 0.994 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.67 -174.851 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -87.99 155.82 19.63 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.925 0.89 . . . . 0.0 110.224 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.55 100.63 3.94 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 170.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.49 -28.23 66.83 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.934 0.894 . . . . 0.0 112.371 -170.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 86.0 t -59.26 -43.37 89.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 123.565 0.746 . . . . 0.0 111.515 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -98.01 -37.81 9.62 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 121.125 0.488 . . . . 0.0 110.443 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.56 49.45 2.75 Favored Glycine 0 C--N 1.343 0.921 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.265 -174.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -138.48 161.64 36.51 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.338 0.655 . . . . 0.0 110.651 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -68.04 137.42 55.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.067 0.947 . . . . 0.0 109.159 170.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.3 pp -111.33 138.34 47.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.629 0.372 . . . . 0.0 110.991 -176.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.47 ' HA ' HD12 ' A' ' 128' ' ' LEU . 76.8 m-70 -141.11 96.61 3.03 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.586 0.754 . . . . 0.0 109.169 167.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.622 ' HA ' ' HA ' ' A' ' 127' ' ' PRO . 3.1 tm? -170.28 141.39 2.03 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 170.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -125.9 111.51 14.89 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 174.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . 0.465 ' SG ' HD12 ' A' ' 110' ' ' LEU . 75.0 m -73.72 112.31 9.7 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 168.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.408 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 27.6 mt-10 -74.13 -37.7 64.01 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 13.5 ptmm? -63.08 -46.98 84.85 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.859 177.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.539 ' HB3' ' HD3' ' A' ' 108' ' ' LYS . 6.9 m-20 -84.61 -28.98 26.13 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.33 0.652 . . . . 0.0 110.648 178.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.57 43.74 91.5 Favored Glycine 0 C--N 1.343 0.953 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.447 -172.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.539 ' HD3' ' HB3' ' A' ' 106' ' ' ASP . 58.4 mtpt -134.33 157.62 45.9 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.818 1.247 . . . . 0.0 109.865 -174.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -103.08 107.9 18.87 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.205 0.602 . . . . 0.0 110.047 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.465 HD12 ' SG ' ' A' ' 103' ' ' CYS . 68.8 mt -107.81 -175.55 2.81 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.896 0.878 . . . . 0.0 110.329 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.451 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 19.6 p -110.43 176.67 4.95 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.015 0.526 . . . . 0.0 110.117 173.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . 0.467 ' O ' ' HG2' ' A' ' 116' ' ' GLN . 51.7 t90 -56.99 -42.4 80.21 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.916 0.76 . . . . 0.0 110.87 173.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.451 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 43.8 t -61.05 -36.45 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 123.558 0.743 . . . . 0.0 111.461 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.456 ' HB2' ' HB3' ' A' ' 110' ' ' LEU . 89.5 m -78.14 -21.82 49.71 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.863 176.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.586 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -72.77 -34.92 67.28 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 170.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 112' ' ' TRP . 12.9 mm100 -79.55 -7.47 58.51 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.325 1.05 . . . . 0.0 111.451 177.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 C--N 1.353 0.719 0 C-N-CA 123.237 0.615 . . . . 0.0 110.839 -178.549 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.454 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . . . . . . 0 CA--C 1.534 0.362 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.457 ' HB3' HD11 ' A' ' 101' ' ' LEU . 23.7 mtm -144.2 119.01 9.88 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.2 m -121.49 137.71 27.33 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 123.929 0.892 . . . . 0.0 109.44 175.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.622 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 32.5 Cg_endo -61.9 155.26 56.01 Favored 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.425 2.083 . . . . 0.0 112.993 177.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.47 HD12 ' HA ' ' A' ' 100' ' ' HIS . 96.7 mt . . . . . 0 N--CA 1.478 0.933 0 C-N-CA 123.404 0.682 . . . . 0.0 110.276 -177.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 . . . . . 0 N--CA 1.469 0.52 0 CA-C-O 121.806 0.812 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -107.79 153.16 23.38 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 113.85 -1.523 . . . . 0.0 109.206 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.8 t -61.82 102.36 0.26 Allowed 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.4 -19.66 64.87 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.291 1.036 . . . . 0.0 113.228 -170.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 19.6 t -66.79 -40.8 86.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.443 0.697 . . . . 0.0 111.124 -178.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.434 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.5 m-70 -104.12 -38.22 7.01 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -177.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.35 37.08 5.2 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-N 114.802 -1.09 . . . . 0.0 112.356 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 1.6 pp20? -132.38 153.76 50.46 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.593 0.757 . . . . 0.0 109.969 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -66.1 133.31 50.46 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.692 0.797 . . . . 0.0 111.101 -173.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.5 pp -98.97 146.38 26.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.499 0.72 . . . . 0.0 110.041 -174.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -145.96 93.27 2.31 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 164.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.544 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -171.42 138.84 1.21 Allowed 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 173.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -125.84 115.91 20.72 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . 0.609 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 30.5 t -84.54 127.05 33.83 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -71.87 -45.54 60.96 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.779 0.832 . . . . 0.0 110.985 -175.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -69.61 -32.06 70.56 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.042 0.537 . . . . 0.0 111.273 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.609 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 29.4 t70 -94.08 -27.42 16.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.249 1.019 . . . . 0.0 110.818 -171.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.33 34.42 89.87 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-N 115.421 -0.809 . . . . 0.0 113.643 178.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -140.09 162.21 35.77 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.174 0.99 . . . . 0.0 110.084 -175.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -95.96 102.4 14.19 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.747 0.819 . . . . 0.0 110.808 -175.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.497 ' HB2' HD12 ' A' ' 101' ' ' LEU . 74.3 mt -91.54 -176.65 4.57 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.217 1.007 . . . . 0.0 110.499 176.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.4 p -116.29 172.94 6.87 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.15 0.58 . . . . 0.0 110.212 174.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 23.3 t90 -59.41 -47.04 86.98 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.906 0.882 . . . . 0.0 111.781 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 39.8 t -57.86 -39.89 73.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 123.561 0.538 . . . . 0.0 110.821 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 99.0 m -79.28 -26.84 42.29 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.106 0.562 . . . . 0.0 111.632 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.544 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -68.02 -37.09 80.99 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.043 0.537 . . . . 0.0 111.118 177.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -106.42 9.16 31.81 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.18 0.592 . . . . 0.0 111.584 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 44.0 t . . . . . 0 N--CA 1.484 1.244 0 C-N-CA 123.057 0.543 . . . . 0.0 110.248 179.254 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.48 ' HB2' HD11 ' A' ' 101' ' ' LEU . 2.0 ptm -169.78 129.66 0.99 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.017 -175.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.4 m -107.25 149.99 39.4 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 124.724 1.21 . . . . 0.0 109.412 174.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -76.24 140.52 22.24 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 122.432 2.088 . . . . 0.0 112.55 176.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 73.4 mt . . . . . 0 N--CA 1.478 0.974 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 173.309 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 . . . . . 0 C--O 1.241 0.647 0 CA-C-O 121.647 0.737 . . . . 0.0 111.444 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 85.0 mtt85 -120.37 151.05 39.8 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 114.271 -1.332 . . . . 0.0 110.198 -175.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -65.69 101.66 0.65 Allowed 'General case' 0 C--N 1.348 0.54 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.06 -29.12 67.08 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.821 0.848 . . . . 0.0 112.984 -171.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 47.4 t -57.14 -42.5 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 123.816 0.847 . . . . 0.0 111.756 -177.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -104.68 -35.07 7.93 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 -176.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.07 -3.3 55.37 Favored Glycine 0 N--CA 1.476 1.303 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.387 -175.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -83.44 164.31 19.99 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.077 0.951 . . . . 0.0 111.071 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.451 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 41.3 ttp180 -64.5 150.95 45.65 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.065 0.946 . . . . 0.0 110.429 173.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -117.37 141.37 48.4 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.829 0.452 . . . . 0.0 110.275 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 15.9 m80 -149.24 93.83 2.14 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 166.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.499 HD12 ' HB2' ' A' ' 110' ' ' LEU . 3.0 tm? -170.43 143.67 2.33 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 170.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -131.2 104.38 7.03 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 176.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 42.0 t -86.03 118.84 25.75 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -76.55 -39.68 52.08 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.225 0.61 . . . . 0.0 111.407 -174.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.16 -38.65 85.82 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.926 0.491 . . . . 0.0 111.34 177.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -81.51 -29.15 33.71 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.184 0.594 . . . . 0.0 110.129 177.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.2 36.1 92.44 Favored Glycine 0 C--N 1.343 0.96 0 CA-C-N 114.815 -1.084 . . . . 0.0 113.398 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -132.22 145.72 51.52 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 124.212 1.005 . . . . 0.0 109.903 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.72 99.74 9.1 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 171.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.499 ' HB2' HD12 ' A' ' 101' ' ' LEU . 83.9 mt -94.76 -176.75 3.97 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.855 0.862 . . . . 0.0 110.533 -178.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.496 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 7.0 p -113.54 164.49 13.57 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 172.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -59.42 -36.21 75.43 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.708 0.803 . . . . 0.0 111.702 178.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.496 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 84.6 t -60.43 -46.03 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 123.233 0.613 . . . . 0.0 111.135 178.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.6 m -78.63 -18.11 54.98 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.692 0.397 . . . . 0.0 111.253 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.33 -41.08 57.6 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.282 0.633 . . . . 0.0 110.201 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -78.76 -17.28 56.05 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.619 0.768 . . . . 0.0 110.803 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.5 t . . . . . 0 C--O 1.241 0.638 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.762 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.652 0 N-CA-C 110.387 -0.227 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 15.4 ptp -132.74 124.41 28.07 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.425 0.69 . . . . 0.0 109.148 167.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.3 m -104.33 136.85 19.12 Favored Pre-proline 0 CA--C 1.552 1.058 0 C-N-CA 123.731 0.813 . . . . 0.0 109.698 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.27 129.86 16.64 Favored 'Trans proline' 0 C--N 1.372 1.787 0 C-N-CA 122.596 2.197 . . . . 0.0 112.206 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 N--CA 1.471 0.606 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.584 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.509 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 82.7 mtp180 -125.61 132.87 52.42 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.849 -175.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -65.89 100.48 0.57 Allowed 'General case' 0 C--N 1.355 0.841 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 176.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.53 -24.61 63.82 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.784 0.834 . . . . 0.0 112.475 -173.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.09 -39.98 87.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 124.268 1.027 . . . . 0.0 111.789 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.479 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 1.9 m-70 -105.51 -31.86 8.78 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.18 -10.66 58.36 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-N 115.12 -0.945 . . . . 0.0 112.539 -175.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.479 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 9.4 pt-20 -73.62 179.34 4.18 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-N 117.429 0.615 . . . . 0.0 110.31 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.509 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 33.5 mtp-105 -69.54 -178.98 1.56 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.689 0.795 . . . . 0.0 111.899 172.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 pp -150.93 145.35 25.55 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.977 173.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 12.7 m170 -152.84 92.95 1.7 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 164.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' A' ' 110' ' ' LEU . 2.6 tm? -170.45 146.76 2.87 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.464 ' N ' HD13 ' A' ' 101' ' ' LEU . 60.2 t80 -140.36 108.53 5.77 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . 0.658 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 43.6 t -79.77 143.02 34.83 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -76.97 -39.98 48.57 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.281 0.632 . . . . 0.0 111.638 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -79.55 -46.42 17.37 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.436 0.294 . . . . 0.0 111.392 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.658 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 32.1 t70 -66.16 -31.74 72.77 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.173 0.589 . . . . 0.0 109.916 178.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.28 16.18 62.17 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.044 -0.98 . . . . 0.0 114.39 173.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -128.22 168.5 15.37 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.744 0.818 . . . . 0.0 109.257 -178.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -83.64 104.44 13.76 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.957 -1.019 . . . . 0.0 110.474 -177.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.526 ' HB2' HD12 ' A' ' 101' ' ' LEU . 82.9 mt -91.22 -179.01 5.31 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.7 0.8 . . . . 0.0 110.656 174.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.547 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 8.8 p -117.92 162.77 17.59 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 171.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -59.9 -33.89 72.45 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.72 0.808 . . . . 0.0 112.112 178.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.547 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 57.7 t -58.91 -44.0 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 C-N-CA 123.36 0.664 . . . . 0.0 110.786 175.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.46 -29.06 61.31 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.465 0.706 . . . . 0.0 111.018 177.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.435 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -67.51 -35.21 78.68 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.965 0.506 . . . . 0.0 111.241 178.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -78.03 -26.96 48.71 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.406 0.682 . . . . 0.0 111.111 177.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.9 t . . . . . 0 C--N 1.35 0.611 0 C-N-CA 123.286 0.634 . . . . 0.0 110.934 -177.135 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.686 0 CA-C-O 121.933 0.873 . . . . 0.0 109.586 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.1 ptp -148.23 156.47 42.6 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.096 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 31.4 m -125.9 147.07 57.62 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 124.644 1.177 . . . . 0.0 109.67 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.7 128.71 10.35 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 122.203 1.936 . . . . 0.0 112.069 174.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 57.6 mt . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 174.289 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.408 ' HG3' ' HA ' ' A' ' 98' ' ' ARG . 0.0 OUTLIER -122.83 138.34 54.67 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.46 0.704 . . . . 0.0 111.078 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.8 t -67.5 101.35 0.97 Allowed 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 169.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.08 -14.59 60.86 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -167.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 77.9 t -68.34 -46.03 81.48 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 123.059 0.544 . . . . 0.0 111.032 175.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -99.42 -39.54 8.32 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.005 0.431 . . . . 0.0 110.664 -174.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.62 2.52 53.08 Favored Glycine 0 CA--C 1.534 1.25 0 CA-C-N 115.4 -0.818 . . . . 0.0 113.16 -172.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -82.05 152.49 26.6 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 117.307 0.554 . . . . 0.0 109.702 177.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.408 ' HA ' ' HG3' ' A' ' 91' ' ' ARG . 54.1 ttp180 -70.09 119.71 14.69 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 123.561 0.744 . . . . 0.0 109.13 174.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -76.49 136.46 39.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -177.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.3 m80 -154.0 93.82 1.68 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.804 0.841 . . . . 0.0 109.234 172.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.474 HD13 ' N ' ' A' ' 102' ' ' PHE . 3.1 tm? -171.44 150.03 2.79 Favored 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 170.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.474 ' N ' HD13 ' A' ' 101' ' ' LEU . 61.2 t80 -138.68 110.94 7.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 48.6 t -84.19 139.64 32.26 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -73.33 -53.65 10.28 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 122.723 0.409 . . . . 0.0 110.665 -174.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.97 -34.88 78.99 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.454 0.702 . . . . 0.0 112.513 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.456 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 30.3 t0 -82.83 -33.02 27.26 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 -177.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.36 25.71 67.1 Favored Glycine 0 C--N 1.351 1.397 0 CA-C-N 115.349 -0.842 . . . . 0.0 113.631 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -120.25 150.3 40.9 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.132 0.973 . . . . 0.0 109.901 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.26 100.52 11.27 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.149 176.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 28.4 mt -90.93 -178.24 5.16 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.344 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.6 p -112.76 178.08 4.41 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 46.8 t90 -63.41 -51.11 67.17 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.401 0.438 . . . . 0.0 111.872 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 97.5 t -61.7 -45.89 97.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 C-N-CA 123.287 0.635 . . . . 0.0 112.175 -174.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 96.7 m -68.99 -25.3 64.45 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 122.738 0.415 . . . . 0.0 111.838 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.96 -51.74 6.9 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 123.113 0.565 . . . . 0.0 111.227 -175.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -81.3 -10.85 59.49 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.734 -172.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 33.5 t . . . . . 0 CA--C 1.537 0.472 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 161.413 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.617 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 15.4 ptm -163.29 117.62 1.63 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.794 0.838 . . . . 0.0 109.409 -170.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 30.2 m -92.05 135.36 27.28 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 122.955 0.502 . . . . 0.0 109.995 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.26 120.65 6.07 Favored 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 122.26 1.974 . . . . 0.0 111.671 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 98.7 mt . . . . . 0 N--CA 1.472 0.625 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 169.99 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.591 ' HG2' ' HD2' ' A' ' 98' ' ' ARG . 69.4 mtt180 -127.69 136.44 51.58 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.913 0.885 . . . . 0.0 109.922 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.1 t -72.71 100.41 2.82 Favored 'General case' 0 C--N 1.354 0.792 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 175.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.78 -30.12 71.25 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.877 0.871 . . . . 0.0 111.861 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 67.8 t -52.46 -40.5 32.82 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 124.961 1.305 . . . . 0.0 112.314 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -103.99 -37.84 7.21 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.46 24.33 18.94 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 114.953 -1.022 . . . . 0.0 111.815 -171.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -103.33 178.72 4.47 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.591 ' HD2' ' HG2' ' A' ' 91' ' ' ARG . 4.7 tpt180 -74.93 166.26 23.94 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 123.759 0.824 . . . . 0.0 109.953 173.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.5 pp -133.6 134.7 43.59 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.526 -0.734 . . . . 0.0 110.594 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.592 ' HA ' HD12 ' A' ' 128' ' ' LEU . 78.7 m-70 -142.17 95.45 2.8 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 166.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.556 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -171.95 154.81 3.61 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 170.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.401 ' N ' HD13 ' A' ' 101' ' ' LEU . 87.9 t80 -135.4 116.09 13.9 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 28.8 t -85.65 124.18 31.9 Favored 'General case' 0 C--N 1.346 0.416 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -73.71 -44.93 55.08 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.408 0.683 . . . . 0.0 110.969 -173.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.3 -40.65 58.35 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.644 -178.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -78.2 -31.91 49.69 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.253 0.621 . . . . 0.0 110.067 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.18 -19.61 25.82 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.619 -0.719 . . . . 0.0 114.538 174.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -88.24 144.13 26.62 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 117.712 0.756 . . . . 0.0 111.45 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.423 ' HB1' HD11 ' A' ' 128' ' ' LEU . . . -73.4 114.81 12.03 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.738 174.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.48 ' HB2' HD12 ' A' ' 101' ' ' LEU . 82.9 mt -98.93 179.19 4.71 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.74 0.816 . . . . 0.0 110.706 -178.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 8.2 p -99.61 164.1 12.21 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 168.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 63.1 t90 -62.62 -36.01 81.41 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 123.42 0.45 . . . . 0.0 111.325 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 85.0 t -59.77 -40.56 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 C-N-CA 123.256 0.623 . . . . 0.0 111.357 176.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 66.8 m -74.68 -20.81 59.72 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.793 0.437 . . . . 0.0 111.157 177.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.556 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -74.85 -44.0 51.46 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.269 0.628 . . . . 0.0 110.968 176.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -96.24 5.71 50.42 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.983 0.913 . . . . 0.0 111.759 -176.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.245 0.84 0 C-N-CA 123.682 0.793 . . . . 0.0 110.99 -176.468 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.735 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 17.6 ptp -155.26 135.4 13.06 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.593 0.757 . . . . 0.0 110.888 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.9 m -114.36 149.98 43.02 Favored Pre-proline 0 N--CA 1.479 0.99 0 C-N-CA 124.665 1.186 . . . . 0.0 108.893 171.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.89 152.19 77.4 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.295 1.997 . . . . 0.0 111.89 173.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.592 HD12 ' HA ' ' A' ' 100' ' ' HIS . 63.8 mt . . . . . 0 N--CA 1.477 0.9 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 170.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 . . . . . 0 N--CA 1.48 1.027 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 46.3 mtm180 -132.69 136.4 46.41 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.777 0.831 . . . . 0.0 111.003 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -74.51 106.42 6.1 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 173.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.68 -17.67 64.12 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -172.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.5 t -67.88 -35.15 71.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.007 0.523 . . . . 0.0 111.359 178.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -107.29 -37.62 6.2 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.196 0.522 . . . . 0.0 109.805 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.18 29.64 12.26 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.058 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -104.72 168.38 9.11 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.281 1.032 . . . . 0.0 109.717 176.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -72.99 124.31 25.22 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 167.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.2 pp -75.91 138.46 41.05 Favored 'General case' 0 C--N 1.357 0.923 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -149.84 94.29 2.15 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.123 0.569 . . . . 0.0 109.531 173.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.549 HD11 ' HB2' ' A' ' 125' ' ' MET . 2.4 tm? -172.24 143.38 1.47 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 105.827 -1.916 . . . . 0.0 105.827 170.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.431 ' N ' HD13 ' A' ' 101' ' ' LEU . 73.9 t80 -127.61 113.62 16.32 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 175.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . 0.535 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 48.8 t -83.29 129.75 35.02 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -178.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -75.01 -41.42 59.42 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.422 0.689 . . . . 0.0 111.452 -175.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -39.57 63.8 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 120.901 0.382 . . . . 0.0 111.113 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.535 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 26.4 t70 -80.6 -30.34 36.83 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.924 0.89 . . . . 0.0 110.687 -178.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.02 8.57 64.86 Favored Glycine 0 C--N 1.343 0.937 0 CA-C-N 115.552 -0.749 . . . . 0.0 114.449 176.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -116.92 -179.71 3.77 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.606 0.763 . . . . 0.0 109.925 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -103.01 109.86 21.56 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.613 0.765 . . . . 0.0 112.084 -172.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.7 mt -93.3 -175.58 3.87 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.857 0.863 . . . . 0.0 110.427 173.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.558 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 0.7 OUTLIER -111.84 149.51 31.7 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 164.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -60.33 -28.45 68.16 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.933 0.493 . . . . 0.0 112.006 -176.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.558 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 71.2 t -61.96 -42.06 93.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.388 0.675 . . . . 0.0 111.277 175.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 89.8 m -75.81 -17.61 59.79 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.009 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.409 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -77.7 -36.88 50.66 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.988 0.515 . . . . 0.0 110.58 169.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -84.57 -3.89 58.69 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.538 0.735 . . . . 0.0 111.414 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.47 0.541 0 C-N-CA 123.641 0.777 . . . . 0.0 109.435 169.8 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.549 ' HB2' HD11 ' A' ' 101' ' ' LEU . 8.2 ptm -155.27 112.33 3.29 Favored 'General case' 0 CA--C 1.555 1.146 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.407 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 34.3 m -96.85 138.63 21.34 Favored Pre-proline 0 N--CA 1.491 1.618 0 C-N-CA 123.502 0.721 . . . . 0.0 111.38 -175.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.434 ' HA ' HD22 ' A' ' 101' ' ' LEU . 58.2 Cg_endo -70.26 123.55 10.04 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.784 2.323 . . . . 0.0 114.312 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 82.7 mt . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 167.545 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 . . . . . 0 N--CA 1.478 0.931 0 CA-C-O 122.266 1.032 . . . . 0.0 108.719 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.508 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 54.2 mtt180 -134.6 136.9 43.26 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.347 -169.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 2.4 t -70.16 99.97 1.58 Allowed 'General case' 0 C--N 1.35 0.595 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 174.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.83 -20.77 65.2 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.451 0.7 . . . . 0.0 112.55 -170.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 50.8 t -63.26 -47.5 91.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 124.042 0.937 . . . . 0.0 111.042 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.506 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 0.8 OUTLIER -93.81 -28.2 16.02 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.727 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.53 27.82 31.54 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.115 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.506 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 9.8 pt-20 -110.27 169.93 8.42 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.835 1.254 . . . . 0.0 108.748 173.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.508 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 45.3 mtm105 -67.89 168.76 11.04 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 121.327 0.584 . . . . 0.0 110.523 168.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -124.72 136.74 54.14 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.99 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.517 ' HA ' HD12 ' A' ' 128' ' ' LEU . 75.2 m-70 -143.89 94.02 2.53 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 167.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.778 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 1.8 tm? -171.59 151.56 2.98 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.872 1.669 . . . . 0.0 106.52 171.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.517 ' N ' HD13 ' A' ' 101' ' ' LEU . 38.9 t80 -141.54 124.95 16.59 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 73.4 m -82.3 123.24 28.89 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.163 0.585 . . . . 0.0 109.991 175.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.632 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 10.9 mm-40 -74.88 -30.06 61.19 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 121.286 0.565 . . . . 0.0 111.416 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -89.78 -38.85 13.51 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.659 -176.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -89.72 -31.33 17.51 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.434 0.694 . . . . 0.0 110.743 -178.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.82 41.39 49.69 Favored Glycine 0 C--N 1.342 0.867 0 CA-C-N 115.741 -0.663 . . . . 0.0 113.779 177.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -133.05 144.43 50.02 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.461 0.704 . . . . 0.0 110.777 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.27 100.75 11.43 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.306 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 66.9 mt -92.02 -177.41 4.69 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.448 0.699 . . . . 0.0 110.322 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 5.6 p -103.35 165.79 10.82 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 168.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 49.6 t90 -64.71 -29.85 70.85 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.213 0.605 . . . . 0.0 111.724 -179.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.35 -39.68 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 122.839 0.456 . . . . 0.0 110.756 177.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 96.9 m -76.05 -17.09 59.8 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.021 0.529 . . . . 0.0 111.426 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.778 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -75.52 -49.1 19.73 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.213 0.605 . . . . 0.0 110.94 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -85.48 -28.23 25.15 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.441 -173.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 CA--C 1.544 0.744 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 166.328 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.632 ' HB1' ' HB2' ' A' ' 104' ' ' GLU . . . . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 121.623 0.725 . . . . 0.0 112.119 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.434 ' HB3' HD11 ' A' ' 101' ' ' LEU . 52.7 mmm -127.07 112.38 15.13 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.788 1.235 . . . . 0.0 108.097 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 33.2 m -116.37 151.39 46.83 Favored Pre-proline 0 N--CA 1.493 1.707 0 C-N-CA 123.47 0.708 . . . . 0.0 110.575 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -78.97 137.81 14.11 Favored 'Trans proline' 0 C--N 1.375 1.925 0 C-N-CA 122.719 2.28 . . . . 0.0 113.122 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 100' ' ' HIS . 60.7 mt . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 171.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 . . . . . 0 N--CA 1.494 1.755 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -126.39 128.52 47.17 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.837 0.855 . . . . 0.0 109.313 -178.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.4 t -68.59 100.64 1.15 Allowed 'General case' 0 C--N 1.349 0.573 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 174.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.06 -19.82 63.32 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.995 0.918 . . . . 0.0 112.496 -175.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.2 t -62.81 -38.68 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.096 0 C-N-CA 124.173 0.989 . . . . 0.0 111.434 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.431 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 2.1 m-70 -108.09 -39.27 5.55 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 120.88 0.371 . . . . 0.0 110.094 -177.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.42 52.3 2.37 Favored Glycine 0 C--N 1.347 1.166 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.138 -170.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.431 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.0 OUTLIER -146.69 161.21 41.07 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.501 1.12 . . . . 0.0 108.774 176.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 60.5 ttt85 -73.6 139.74 45.74 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.335 0.654 . . . . 0.0 110.995 -178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -105.44 137.16 43.72 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.216 1.007 . . . . 0.0 110.397 -176.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -141.02 93.29 2.57 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 165.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.523 HD11 ' HB3' ' A' ' 125' ' ' MET . 1.6 tm? -172.07 155.7 3.8 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 170.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.519 ' N ' HD13 ' A' ' 101' ' ' LEU . 33.0 t80 -153.5 121.55 6.11 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 171.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . 0.638 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 46.4 t -96.02 130.65 42.97 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 176.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -67.05 -47.9 69.92 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.612 0.765 . . . . 0.0 110.903 -175.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -75.96 -35.58 59.61 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -177.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.638 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 10.1 t70 -70.69 -33.11 70.55 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 176.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.42 30.85 78.82 Favored Glycine 0 C--N 1.342 0.902 0 CA-C-N 114.875 -1.057 . . . . 0.0 114.55 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -130.25 149.59 51.88 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.484 0.714 . . . . 0.0 109.585 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.98 100.27 9.6 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.652 -0.869 . . . . 0.0 108.652 174.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 75.5 mt -88.46 176.12 7.31 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.312 -176.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.467 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 12.6 p -115.28 173.13 6.67 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 172.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -59.21 -40.38 85.59 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 123.227 0.329 . . . . 0.0 111.358 176.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.467 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 59.2 t -61.65 -43.5 97.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.494 0.718 . . . . 0.0 111.484 -178.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.1 m -78.72 -18.22 54.64 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.442 0.297 . . . . 0.0 111.282 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.428 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -76.91 -43.94 33.69 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.412 0.685 . . . . 0.0 110.677 176.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -77.53 -16.92 58.4 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.337 0.655 . . . . 0.0 110.59 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 19.5 t . . . . . 0 CA--C 1.546 0.808 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 172.65 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.923 0 CA-C-O 121.909 0.861 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.523 ' HB3' HD11 ' A' ' 101' ' ' LEU . 90.0 mtp -101.74 106.46 17.47 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 21.1 m -104.77 149.37 37.42 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 124.281 1.032 . . . . 0.0 109.924 -177.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.01 151.4 50.11 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 122.097 1.864 . . . . 0.0 111.092 172.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 45.7 mt . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 121.478 0.656 . . . . 0.0 110.503 177.967 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 121.155 0.502 . . . . 0.0 110.913 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -123.51 138.47 54.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.433 0.693 . . . . 0.0 110.739 -176.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.2 t -69.45 102.62 1.83 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.697 0.799 . . . . 0.0 108.967 174.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.8 -8.32 47.22 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.971 0.908 . . . . 0.0 113.148 -173.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 55.0 t -75.07 -38.92 43.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 C-N-CA 123.385 0.674 . . . . 0.0 111.042 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -106.67 -37.25 6.48 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 -176.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.89 32.8 6.64 Favored Glycine 0 N--CA 1.474 1.201 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.092 -173.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -118.74 167.01 12.08 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.608 1.163 . . . . 0.0 109.282 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -71.7 144.32 49.36 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.306 0.643 . . . . 0.0 109.45 172.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -106.33 136.82 45.39 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -144.49 95.4 2.7 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 167.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.452 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.9 tm? -170.35 146.69 2.91 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 170.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.447 ' HB2' HD21 ' A' ' 128' ' ' LEU . 39.1 t80 -140.16 112.96 8.09 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 69.7 m -66.81 115.46 6.62 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.656 0.783 . . . . 0.0 110.231 173.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -69.24 -29.77 67.76 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.014 0.525 . . . . 0.0 111.537 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -84.12 -48.27 10.03 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.139 0.576 . . . . 0.0 111.42 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.91 -16.85 29.13 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.218 0.607 . . . . 0.0 111.073 -170.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.63 35.07 89.34 Favored Glycine 0 C--N 1.347 1.163 0 C-N-CA 123.573 0.606 . . . . 0.0 114.456 175.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -129.45 149.41 51.24 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.634 0.774 . . . . 0.0 110.48 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -95.28 103.05 14.9 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.453 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.6 mt -94.36 -179.3 4.87 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.516 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 10.6 p -111.43 173.81 6.17 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 171.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 32.2 t90 -59.07 -42.14 89.68 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.159 0.584 . . . . 0.0 111.5 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.75 -41.49 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.212 0 C-N-CA 123.565 0.746 . . . . 0.0 111.714 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.3 m -78.52 -14.05 59.54 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 122.58 0.352 . . . . 0.0 111.147 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.452 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -80.67 -49.27 11.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.255 0.622 . . . . 0.0 110.475 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -75.52 -16.94 60.23 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.008 0.923 . . . . 0.0 112.002 -173.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.2 p . . . . . 0 N--CA 1.482 1.171 0 C-N-CA 123.427 0.691 . . . . 0.0 111.789 179.42 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.879 0 CA-C-O 121.421 0.629 . . . . 0.0 111.99 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 21.3 ptm -157.63 116.0 3.15 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.357 -176.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.4 m -103.65 150.03 37.7 Favored Pre-proline 0 N--CA 1.483 1.205 0 C-N-CA 123.843 0.857 . . . . 0.0 110.31 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -80.52 139.6 12.87 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 122.163 1.909 . . . . 0.0 111.698 174.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.447 HD21 ' HB2' ' A' ' 102' ' ' PHE . 74.9 mt . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.977 0.417 . . . . 0.0 110.087 178.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 N--CA 1.473 0.724 0 CA-C-O 121.22 0.533 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 65.8 mtm180 -132.28 134.86 45.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.593 1.157 . . . . 0.0 109.578 -175.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -69.09 101.78 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 171.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.51 -7.16 48.61 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.58 0.752 . . . . 0.0 112.603 -172.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -67.25 -50.93 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 123.484 0.714 . . . . 0.0 110.221 174.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -95.06 -36.99 11.31 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.655 -176.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.48 42.62 4.18 Favored Glycine 0 C--N 1.347 1.149 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.029 -175.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -126.45 156.63 40.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.155 0.982 . . . . 0.0 109.648 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -67.53 128.62 37.12 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.875 0.87 . . . . 0.0 109.771 172.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 pp -97.51 143.56 28.09 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 122.945 0.498 . . . . 0.0 110.565 -178.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -147.55 96.09 2.63 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 164.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.5 tm? -170.26 151.8 3.95 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 106.164 -1.791 . . . . 0.0 106.164 169.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.469 ' N ' HD13 ' A' ' 101' ' ' LEU . 32.7 t80 -137.15 115.84 12.12 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 175.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . 0.637 ' HB3' ' HB2' ' A' ' 106' ' ' ASP . 6.4 t -78.59 134.84 37.17 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.569 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 13.9 mm-40 -77.26 -40.14 45.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.774 0.43 . . . . 0.0 111.113 177.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -74.68 -42.01 59.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.674 0.389 . . . . 0.0 111.181 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.637 ' HB2' ' HB3' ' A' ' 103' ' ' CYS . 1.9 m-20 -81.3 -25.22 36.66 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.999 0.92 . . . . 0.0 110.958 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.23 25.14 69.51 Favored Glycine 0 C--N 1.355 1.611 0 O-C-N 123.383 0.427 . . . . 0.0 113.84 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -132.5 153.98 50.38 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.265 0.626 . . . . 0.0 110.705 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.66 103.41 7.58 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.822 0.849 . . . . 0.0 110.666 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 84.1 mt -94.43 -177.78 4.36 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.109 0.964 . . . . 0.0 110.861 176.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.49 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 4.7 p -112.12 162.59 15.26 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -53.02 -40.43 63.87 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.362 0.665 . . . . 0.0 112.401 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.49 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 62.1 t -60.6 -44.41 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 C-N-CA 123.676 0.79 . . . . 0.0 111.266 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.8 m -79.86 -19.45 48.3 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 122.586 0.354 . . . . 0.0 111.739 177.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.534 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -71.18 -53.73 13.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.359 0.664 . . . . 0.0 110.987 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -75.65 -14.6 60.37 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.257 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--N 1.356 0.88 0 C-N-CA 123.662 0.785 . . . . 0.0 109.126 174.094 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.569 ' HB1' ' HB2' ' A' ' 104' ' ' GLU . . . . . . . . 0 CA--C 1.541 0.607 0 CA-C-O 120.999 0.428 . . . . 0.0 110.43 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.3 ptp -159.18 151.13 20.81 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.141 0.977 . . . . 0.0 109.755 176.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 34.7 m -125.62 142.18 41.22 Favored Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 124.37 1.068 . . . . 0.0 109.336 176.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -73.65 126.11 10.57 Favored 'Trans proline' 0 C--N 1.373 1.867 0 C-N-CA 122.037 1.825 . . . . 0.0 111.981 176.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 49.0 mt . . . . . 0 N--CA 1.473 0.684 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 172.434 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 122.175 0.988 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.424 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 94.0 mtt180 -120.57 138.23 53.99 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 114.66 -1.155 . . . . 0.0 109.679 173.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -68.98 102.18 1.54 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 173.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.29 -20.52 62.99 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -169.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.5 t -67.24 -47.08 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.226 0.611 . . . . 0.0 111.13 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.547 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.0 OUTLIER -93.62 -38.66 11.23 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -177.079 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.69 36.92 6.64 Favored Glycine 0 C--N 1.35 1.357 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.889 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.547 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.4 OUTLIER -127.86 166.2 18.71 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.059 0.944 . . . . 0.0 109.97 176.453 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.424 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 2.9 tpt180 -71.17 124.87 25.44 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.217 1.007 . . . . 0.0 110.869 -173.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.8 pp -89.19 131.62 35.23 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 178.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -149.96 96.76 2.49 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.259 1.024 . . . . 0.0 108.612 165.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.536 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 3.1 tm? -168.74 149.76 4.64 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 174.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -139.17 118.01 12.4 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . 0.59 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 42.4 t -84.44 123.74 30.57 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 172.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -62.32 -46.93 86.53 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.864 0.865 . . . . 0.0 112.868 -169.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -87.84 -29.84 20.63 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -177.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.59 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 27.2 t70 -72.81 -32.86 65.84 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-O 121.049 0.452 . . . . 0.0 110.586 178.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.46 18.59 73.72 Favored Glycine 0 C--N 1.34 0.783 0 CA-C-N 115.274 -0.875 . . . . 0.0 115.214 173.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -112.53 153.07 28.06 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 117.825 0.813 . . . . 0.0 110.032 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.48 101.03 13.52 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.792 -1.094 . . . . 0.0 108.416 178.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.495 ' HB2' HD12 ' A' ' 101' ' ' LEU . 27.8 mt -91.8 -176.97 4.62 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.096 0.959 . . . . 0.0 109.554 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.628 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 2.9 p -111.19 158.82 18.49 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 171.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -60.9 -33.62 73.4 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.413 0.685 . . . . 0.0 110.997 178.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.628 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 60.4 t -58.55 -43.04 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 C-N-CA 123.585 0.754 . . . . 0.0 111.331 177.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 69.1 m -72.74 -29.87 63.69 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.728 177.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.536 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -68.56 -48.02 65.34 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.276 0.63 . . . . 0.0 111.244 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -78.03 -9.31 59.06 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.579 0.752 . . . . 0.0 112.018 -176.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 39.1 t . . . . . 0 C--O 1.247 0.948 0 C-N-CA 123.475 0.71 . . . . 0.0 109.894 174.249 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 120.922 0.392 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.6 ptp -141.73 132.42 25.59 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.499 178.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.5 m -112.13 144.46 30.81 Favored Pre-proline 0 N--CA 1.481 1.119 0 C-N-CA 124.999 1.32 . . . . 0.0 109.9 177.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.64 147.08 50.49 Favored 'Trans proline' 0 C--N 1.375 1.922 0 C-N-CA 122.538 2.159 . . . . 0.0 112.258 178.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 69.9 mt . . . . . 0 N--CA 1.476 0.831 0 C-N-CA 123.142 0.577 . . . . 0.0 109.824 177.935 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 N--CA 1.475 0.796 0 CA-C-O 121.068 0.461 . . . . 0.0 110.007 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -128.3 127.88 43.58 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.905 0.882 . . . . 0.0 109.918 -177.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -68.86 103.29 1.75 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.63 -23.5 51.49 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -168.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 46.3 t -59.8 -44.98 95.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.528 0.731 . . . . 0.0 111.549 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -104.84 -38.75 6.54 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -172.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.09 -6.46 58.24 Favored Glycine 0 C--N 1.349 1.252 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.533 -170.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -67.46 165.0 17.56 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.946 0.898 . . . . 0.0 110.205 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.91 132.68 43.79 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 170.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 pp -92.66 129.58 38.55 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 178.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -147.96 95.01 2.42 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 171.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.475 HD11 ' HB3' ' A' ' 125' ' ' MET . 2.9 tm? -171.14 121.32 0.53 Allowed 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 173.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -96.62 111.39 23.55 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 172.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 38.2 t -87.31 108.34 18.92 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -73.64 -19.97 60.7 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -174.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.557 ' HE3' ' SD ' ' A' ' 125' ' ' MET . 21.5 pttp -84.89 -36.43 21.5 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.253 0.621 . . . . 0.0 111.038 177.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -87.69 -26.9 22.74 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.297 0.639 . . . . 0.0 110.048 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.93 17.41 71.54 Favored Glycine 0 C--N 1.343 0.933 0 CA-C-N 115.015 -0.993 . . . . 0.0 113.804 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 108' ' ' LYS . 0.0 OUTLIER -122.71 170.31 10.18 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 123.733 0.813 . . . . 0.0 110.181 -179.243 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.43 108.15 20.07 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.124 -173.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.1 mt -100.9 -177.2 3.39 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.711 1.204 . . . . 0.0 111.334 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.0 p -112.9 161.57 16.83 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 43.2 t90 -54.66 -44.15 73.01 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.025 0.93 . . . . 0.0 112.038 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.6 t -60.45 -41.0 85.96 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.661 0.785 . . . . 0.0 111.586 -176.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 97.1 m -75.37 -26.1 58.22 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.653 0.381 . . . . 0.0 111.594 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.65 -36.0 62.85 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.19 0.596 . . . . 0.0 111.001 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -94.92 -2.66 50.14 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.602 0.761 . . . . 0.0 111.715 -178.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 CA--C 1.551 1.018 0 C-N-CA 123.66 0.784 . . . . 0.0 111.41 -178.265 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.759 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.557 ' SD ' ' HE3' ' A' ' 105' ' ' LYS . 72.8 mtp -129.33 107.24 9.37 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 178.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 33.9 m -91.22 161.69 34.3 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.06 0.944 . . . . 0.0 110.006 -173.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -76.11 167.75 25.38 Favored 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 122.173 1.915 . . . . 0.0 112.28 174.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 15.5 mt . . . . . 0 N--CA 1.485 1.277 0 C-N-CA 123.64 0.776 . . . . 0.0 111.411 -177.484 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.417 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.521 0.677 . . . . 0.0 110.66 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 84.9 mtt85 -110.04 132.38 54.22 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.578 -0.701 . . . . 0.0 110.638 -178.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -62.47 103.06 0.37 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.965 1.306 . . . . 0.0 109.517 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.02 -15.7 35.01 Favored 'General case' 0 N--CA 1.486 1.333 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -166.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 97.8 t -74.61 -43.97 47.38 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 123.16 0.584 . . . . 0.0 111.335 177.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -100.28 -39.91 7.79 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.222 0.534 . . . . 0.0 110.603 -173.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.05 -10.71 60.29 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.555 -168.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -74.28 145.78 43.72 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.632 0.773 . . . . 0.0 109.856 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 58.3 ttp180 -62.5 144.19 56.3 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.663 0.785 . . . . 0.0 110.894 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 2.7 pp -109.48 141.75 41.48 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 123.635 0.774 . . . . 0.0 110.498 -175.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -148.61 94.46 2.28 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 164.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.459 HD21 ' SD ' ' A' ' 125' ' ' MET . 1.5 tp -170.01 158.55 7.18 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.082 1.353 . . . . 0.0 108.363 172.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.414 ' N ' ' HG ' ' A' ' 101' ' ' LEU . 67.4 t80 -138.05 109.79 7.11 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.831 0.852 . . . . 0.0 109.892 177.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 97.4 m -65.61 110.89 2.91 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.737 0.815 . . . . 0.0 108.966 168.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -76.13 -32.55 59.18 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.876 0.87 . . . . 0.0 110.919 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.537 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 15.2 ptmm? -81.58 -11.94 58.95 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.487 -176.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -131.32 -27.82 1.95 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.614 0.366 . . . . 0.0 111.036 -172.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.96 40.34 21.44 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 116.084 -0.507 . . . . 0.0 113.592 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -120.02 153.61 35.78 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.822 0.849 . . . . 0.0 110.253 179.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.97 106.97 17.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.245 0.618 . . . . 0.0 109.729 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.7 mt -107.14 -175.74 2.88 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.469 0.707 . . . . 0.0 109.832 178.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.574 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 19.9 p -105.4 167.02 10.02 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 171.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 65.9 t90 -56.56 -36.27 69.13 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 124.236 1.015 . . . . 0.0 111.798 173.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.574 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 60.1 t -59.53 -37.53 70.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 123.479 0.712 . . . . 0.0 111.385 176.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 59.4 m -72.78 -23.32 60.79 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.894 0.478 . . . . 0.0 110.993 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -87.9 -1.94 58.3 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.599 0.76 . . . . 0.0 111.717 173.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -120.22 12.82 11.88 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.358 0.663 . . . . 0.0 110.398 173.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 42.9 t . . . . . 0 C--O 1.243 0.761 0 C-N-CA 124.33 1.052 . . . . 0.0 111.916 -175.353 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.537 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 121.063 0.459 . . . . 0.0 109.881 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.459 ' SD ' HD21 ' A' ' 101' ' ' LEU . 15.0 ptp -156.03 129.71 8.42 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 124.36 1.064 . . . . 0.0 109.255 -178.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.4 m -106.29 134.33 19.83 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 123.559 0.744 . . . . 0.0 109.895 175.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.85 120.32 7.24 Favored 'Trans proline' 0 C--N 1.368 1.589 0 C-N-CA 122.309 2.006 . . . . 0.0 110.625 174.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.5 mt . . . . . 0 N--CA 1.471 0.618 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.707 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 121.284 0.564 . . . . 0.0 110.584 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -122.4 134.09 54.62 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 125.749 1.62 . . . . 0.0 108.652 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.445 ' HB2' ' HB3' ' A' ' 111' ' ' CYS . 18.8 t -64.61 103.26 0.65 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.0 -19.32 12.14 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -169.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.4 t -69.17 -51.29 44.86 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 123.368 0.667 . . . . 0.0 111.13 179.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -95.39 -38.4 10.51 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.008 0.432 . . . . 0.0 110.14 -173.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.16 17.79 36.05 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.413 -0.812 . . . . 0.0 113.759 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.425 ' OE2' ' HB3' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -105.4 166.72 10.23 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 117.676 0.738 . . . . 0.0 110.012 174.055 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -68.71 123.99 22.43 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.513 1.125 . . . . 0.0 110.633 -175.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.1 pp -90.7 131.07 36.6 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.495 0.718 . . . . 0.0 109.125 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -143.84 93.77 2.5 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 165.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.641 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -170.11 150.81 3.8 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 170.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.454 ' N ' HD13 ' A' ' 101' ' ' LEU . 84.1 t80 -144.52 110.43 5.39 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 176.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 43.9 t -86.28 112.85 21.78 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 178.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -73.6 -31.37 63.54 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.098 0.959 . . . . 0.0 111.596 -176.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.83 -45.13 21.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.854 0.462 . . . . 0.0 111.111 177.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -79.89 -22.93 42.22 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.622 0.769 . . . . 0.0 109.985 -177.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.72 40.57 93.92 Favored Glycine 0 C--N 1.344 1.027 0 C-N-CA 123.905 0.764 . . . . 0.0 114.146 177.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -132.69 138.78 47.39 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.658 0.783 . . . . 0.0 110.61 177.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.04 100.21 8.06 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 169.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.554 ' HB2' HD12 ' A' ' 101' ' ' LEU . 83.7 mt -95.28 -178.47 4.46 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.67 0.788 . . . . 0.0 111.02 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.456 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 13.7 p -110.74 173.06 6.51 Favored 'General case' 0 C--O 1.244 0.792 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 172.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -59.34 -38.7 81.03 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.158 0.583 . . . . 0.0 111.617 175.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.456 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 41.7 t -62.72 -43.04 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 C-N-CA 123.529 0.731 . . . . 0.0 111.101 -178.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.8 m -78.71 -15.54 58.34 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.072 0.549 . . . . 0.0 111.45 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.641 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -78.74 -33.27 46.75 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.38 0.672 . . . . 0.0 110.331 173.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -80.57 -27.16 37.54 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.722 0.809 . . . . 0.0 110.274 175.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--N 1.351 0.659 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.346 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.195 0 CA-C-O 121.11 0.481 . . . . 0.0 111.815 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.52 ' HB3' HD11 ' A' ' 101' ' ' LEU . 20.9 mtm -136.06 109.95 8.18 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.803 0.841 . . . . 0.0 108.976 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 26.8 m -103.8 132.43 21.05 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 123.647 0.779 . . . . 0.0 110.184 177.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.543 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 49.2 Cg_endo -67.32 141.84 58.0 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.303 2.002 . . . . 0.0 111.137 175.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 86.7 mt . . . . . 0 N--CA 1.47 0.553 0 CA-C-O 121.127 0.489 . . . . 0.0 110.031 -179.841 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.472 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 2.3 mp0 . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.522 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 32.8 mtp85 -130.86 131.45 44.57 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.622 0.769 . . . . 0.0 110.056 -173.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.5 t -69.46 101.47 1.58 Allowed 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.71 -10.76 55.26 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -169.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 60.8 t -68.73 -51.44 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.54 0.736 . . . . 0.0 110.558 175.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -89.5 -31.84 17.47 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 -178.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.71 -0.37 67.48 Favored Glycine 0 C--N 1.351 1.416 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.123 -175.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -78.55 159.07 28.34 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.915 0.886 . . . . 0.0 111.086 -178.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.522 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 7.9 tpt180 -71.98 132.58 44.49 Favored 'General case' 0 CA--C 1.552 1.02 0 O-C-N 124.011 0.819 . . . . 0.0 109.158 167.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 4.1 pp -101.2 148.62 24.88 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 122.932 0.493 . . . . 0.0 110.17 -177.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.428 ' HA ' HD12 ' A' ' 128' ' ' LEU . 66.5 m80 -144.91 94.88 2.6 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 123.945 0.778 . . . . 0.0 109.096 167.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.602 ' HA ' ' HA ' ' A' ' 127' ' ' PRO . 3.2 tm? -170.43 115.4 0.48 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -95.16 113.17 24.82 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 35.8 t -85.43 112.92 21.31 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -75.87 -32.84 59.89 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.581 0.753 . . . . 0.0 111.612 -174.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 21.2 ptmt -74.62 -39.51 62.09 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.711 0.404 . . . . 0.0 111.177 178.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -86.18 -26.59 25.04 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.616 0.766 . . . . 0.0 109.707 -177.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.41 27.19 73.04 Favored Glycine 0 C--N 1.341 0.857 0 C-N-CA 124.126 0.869 . . . . 0.0 113.811 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -131.73 152.99 50.51 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.73 0.812 . . . . 0.0 110.703 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.33 100.24 11.13 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.215 178.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.473 ' HB2' HD12 ' A' ' 101' ' ' LEU . 21.1 mt -89.61 -177.71 5.36 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.761 0.824 . . . . 0.0 109.893 175.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.52 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 1.3 p -112.44 160.72 17.47 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 173.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 47.5 t90 -52.28 -43.3 64.35 Favored 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 124.592 1.157 . . . . 0.0 112.253 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.52 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 95.7 t -59.16 -46.98 91.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 123.55 0.74 . . . . 0.0 111.594 -179.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 71.4 m -79.28 -14.76 58.81 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.668 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.481 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -82.16 -39.52 23.1 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.565 0.746 . . . . 0.0 110.65 177.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -91.83 14.75 14.59 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.205 0.602 . . . . 0.0 110.673 176.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 N--CA 1.473 0.719 0 C-N-CA 123.779 0.832 . . . . 0.0 110.304 169.132 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.402 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . . . . . . 0 C--O 1.237 0.408 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.544 ' HB2' HD11 ' A' ' 101' ' ' LEU . 9.3 ptm -167.11 110.94 0.71 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.768 0.827 . . . . 0.0 109.959 -169.314 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.6 m -116.26 136.86 23.12 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.839 1.255 . . . . 0.0 110.063 -178.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . 0.602 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 28.6 Cg_endo -61.31 142.64 96.68 Favored 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.665 2.243 . . . . 0.0 113.124 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 100' ' ' HIS . 93.2 mt . . . . . 0 N--CA 1.477 0.909 0 C-N-CA 123.35 0.66 . . . . 0.0 109.503 175.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 . . . . . 0 N--CA 1.482 1.169 0 CA-C-O 120.666 0.27 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.427 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 76.2 mtp180 -124.17 133.88 53.45 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.285 0.634 . . . . 0.0 110.998 -170.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.1 t -67.46 100.41 0.85 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 171.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.45 -13.7 62.27 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -168.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 98.8 t -61.93 -43.98 98.25 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 C-N-CA 123.21 0.604 . . . . 0.0 111.25 173.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -104.37 -38.02 6.99 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 121.508 0.671 . . . . 0.0 109.814 -176.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.79 -3.29 52.69 Favored Glycine 0 CA--C 1.532 1.133 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.616 -172.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.55 157.45 33.87 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 118.159 0.98 . . . . 0.0 109.911 177.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.427 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 36.1 ttp-105 -72.43 124.09 24.45 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 173.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -83.95 134.84 34.64 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.423 0.689 . . . . 0.0 109.584 -177.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -146.41 94.77 2.5 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 168.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.553 HD11 ' SD ' ' A' ' 125' ' ' MET . 2.4 tm? -171.79 153.46 3.32 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 171.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.467 ' N ' HD13 ' A' ' 101' ' ' LEU . 77.1 t80 -143.81 120.06 10.85 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 173.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 44.7 t -82.69 125.64 31.46 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -69.45 -32.4 71.32 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.061 0.944 . . . . 0.0 112.106 -177.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.95 -41.55 11.07 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.716 0.407 . . . . 0.0 111.459 -178.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.427 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 37.0 t70 -78.85 -28.43 44.27 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.257 0.623 . . . . 0.0 110.723 -177.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.54 35.85 62.71 Favored Glycine 0 C--N 1.351 1.392 0 CA-C-N 116.027 -0.533 . . . . 0.0 114.22 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -133.67 147.09 51.39 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.328 0.651 . . . . 0.0 111.58 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.96 100.51 9.72 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.516 176.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 77.4 mt -100.62 -175.79 3.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.173 0.989 . . . . 0.0 111.008 -176.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.421 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 10.1 p -110.68 170.84 7.82 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 168.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 82.9 t90 -57.24 -47.01 82.44 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.807 0.443 . . . . 0.0 111.653 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.421 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 71.1 t -55.28 -47.61 77.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 C-N-CA 123.916 0.886 . . . . 0.0 112.387 -175.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 74.4 m -76.68 -19.72 57.42 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.548 0.339 . . . . 0.0 111.554 -178.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.21 -34.37 32.28 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.42 0.629 . . . . 0.0 110.567 177.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -114.45 17.56 17.33 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.252 -170.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 38.7 t . . . . . 0 C--O 1.244 0.774 0 C-N-CA 123.408 0.683 . . . . 0.0 110.302 175.536 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.004 0 CA-C-O 121.399 0.619 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.553 ' SD ' HD11 ' A' ' 101' ' ' LEU . 7.0 mmt -121.05 119.78 33.46 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.099 1.36 . . . . 0.0 108.374 177.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 36.0 m -117.7 145.71 37.08 Favored Pre-proline 0 N--CA 1.488 1.451 0 C-N-CA 123.703 0.801 . . . . 0.0 110.826 -176.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -70.66 151.63 64.07 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.869 2.379 . . . . 0.0 113.377 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 87.3 mt . . . . . 0 N--CA 1.468 0.448 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 168.653 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.516 ' HG3' ' HG3' ' A' ' 91' ' ' ARG . 6.3 pt-20 . . . . . 0 N--CA 1.481 1.098 0 CA-C-O 120.891 0.377 . . . . 0.0 111.305 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.516 ' HG3' ' HG3' ' A' ' 90' ' ' GLU . 60.9 mtt85 -118.96 136.09 54.26 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.476 1.111 . . . . 0.0 108.763 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 8.8 t -69.71 102.0 1.8 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 173.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.73 -20.03 63.06 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -170.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.3 t -62.53 -40.34 87.85 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.299 0 C-N-CA 123.973 0.909 . . . . 0.0 111.651 177.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.49 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.3 m-70 -107.59 -38.23 5.96 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.16 0.505 . . . . 0.0 110.095 -177.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.31 25.65 15.85 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.457 -0.792 . . . . 0.0 113.2 -176.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.49 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.0 OUTLIER -113.36 152.49 29.9 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.608 0.763 . . . . 0.0 109.535 174.13 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -70.21 122.94 20.45 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.315 0.646 . . . . 0.0 109.688 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.6 pp -80.97 138.61 36.08 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.985 -171.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -144.79 98.12 3.13 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.547 0.739 . . . . 0.0 109.78 167.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.686 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 1.9 tm? -168.28 143.09 3.48 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 105.243 -2.132 . . . . 0.0 105.243 169.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.407 ' N ' HD13 ' A' ' 101' ' ' LEU . 37.9 t80 -129.69 115.23 17.03 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . 0.43 ' SG ' ' HG2' ' A' ' 105' ' ' LYS . 47.5 t -97.02 131.97 43.3 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.378 0.671 . . . . 0.0 109.386 179.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -74.3 -52.21 12.94 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.004 0.922 . . . . 0.0 111.121 -178.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.43 ' HG2' ' SG ' ' A' ' 103' ' ' CYS . 14.8 ptmm? -63.07 -38.66 92.07 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.042 0.537 . . . . 0.0 111.06 -176.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -83.66 -29.66 27.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.7 0.8 . . . . 0.0 109.857 -178.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.19 34.71 88.97 Favored Glycine 0 C--N 1.346 1.131 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.518 179.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -132.7 147.35 52.33 Favored 'General case' 0 C--O 1.242 0.67 0 C-N-CA 123.44 0.696 . . . . 0.0 110.738 -172.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.23 99.99 10.91 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 114.333 -1.303 . . . . 0.0 108.341 172.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 59.8 mt -93.9 -177.3 4.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.023 0.929 . . . . 0.0 110.242 179.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.505 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 2.8 p -108.9 159.68 16.61 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 173.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -58.85 -33.92 71.0 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.281 0.632 . . . . 0.0 111.765 177.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.505 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 28.6 t -63.69 -43.47 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.312 0 C-N-CA 123.622 0.769 . . . . 0.0 111.021 -179.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 91.5 m -77.73 -17.91 57.09 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 122.936 0.494 . . . . 0.0 111.186 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.686 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -73.52 -40.65 63.87 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 122.844 0.458 . . . . 0.0 110.304 170.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -87.19 -9.94 53.9 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.524 0.73 . . . . 0.0 112.369 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 80.4 p . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 168.813 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.938 0 CA-C-O 121.462 0.649 . . . . 0.0 111.321 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 84.0 mtp -122.24 109.1 14.05 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.5 m -108.03 162.71 18.91 Favored Pre-proline 0 N--CA 1.48 1.05 0 C-N-CA 124.488 1.115 . . . . 0.0 109.303 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -66.82 150.35 83.28 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 121.787 1.658 . . . . 0.0 110.877 171.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.468 ' HB2' ' N ' ' A' ' 101' ' ' LEU . 1.7 tt . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 59.2 mtm-85 -115.34 135.0 54.59 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.843 1.257 . . . . 0.0 108.796 174.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.409 ' HB3' ' OE2' ' A' ' 97' ' ' GLU . 10.3 t -69.42 102.07 1.7 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 176.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -50.66 -30.13 12.82 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.842 1.257 . . . . 0.0 113.906 -172.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.71 -42.87 96.23 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.071 0 C-N-CA 123.421 0.689 . . . . 0.0 112.002 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.9 -37.79 8.09 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 120.997 0.427 . . . . 0.0 110.21 -175.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.91 3.88 54.64 Favored Glycine 0 C--N 1.346 1.108 0 CA-C-N 115.472 -0.786 . . . . 0.0 113.844 178.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.409 ' OE2' ' HB3' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -94.79 166.46 11.97 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-N 117.765 0.782 . . . . 0.0 109.882 177.376 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -73.09 120.91 19.38 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.039 0.535 . . . . 0.0 110.142 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -80.17 136.99 36.61 Favored 'General case' 0 C--N 1.349 0.551 0 C-N-CA 123.711 0.804 . . . . 0.0 109.587 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -145.0 95.01 2.62 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 166.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.532 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.6 tm? -172.16 149.3 2.29 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 168.117 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.476 ' HB2' HD21 ' A' ' 128' ' ' LEU . 79.0 t80 -130.5 114.23 15.24 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 172.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . 0.536 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 41.1 t -84.22 120.15 25.87 Favored 'General case' 0 C--O 1.227 -0.103 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 177.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -70.87 -39.59 72.79 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.613 0.765 . . . . 0.0 111.152 -172.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.44 -34.47 58.76 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.224 -178.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.536 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 32.6 t70 -84.93 -26.62 27.11 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.011 0.924 . . . . 0.0 110.318 -179.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.65 13.96 69.27 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-N 114.373 -1.285 . . . . 0.0 114.81 176.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -113.98 150.02 34.46 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-N 117.415 0.607 . . . . 0.0 110.45 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.21 101.32 7.03 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.697 -1.138 . . . . 0.0 108.697 174.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 75.7 mt -94.92 -177.28 4.11 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.813 0.845 . . . . 0.0 110.58 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.611 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 9.7 p -111.81 168.25 9.73 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 173.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 26.4 t90 -65.04 -32.14 73.72 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 122.745 0.418 . . . . 0.0 111.197 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.611 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 44.2 t -59.43 -46.36 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 C-N-CA 123.681 0.792 . . . . 0.0 110.909 177.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 83.2 m -79.41 -19.2 50.6 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.895 0.478 . . . . 0.0 111.348 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.532 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -71.36 -49.44 42.26 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.188 0.595 . . . . 0.0 110.618 177.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -77.31 -18.42 57.51 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.28 0.632 . . . . 0.0 111.187 177.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 35.8 t . . . . . 0 C--N 1.355 0.826 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 173.304 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.467 0 CA-C-O 121.107 0.48 . . . . 0.0 109.964 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 17.9 ptp -161.85 142.27 10.47 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.184 0.994 . . . . 0.0 109.949 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 17.4 m -127.96 150.17 72.85 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.039 1.336 . . . . 0.0 109.868 179.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -74.32 140.81 27.97 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 122.504 2.136 . . . . 0.0 112.383 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.476 HD21 ' HB2' ' A' ' 102' ' ' PHE . 74.8 mt . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 N--CA 1.47 0.53 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -129.34 135.27 48.52 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.75 0.42 . . . . 0.0 111.597 -172.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.9 t -73.16 102.05 3.49 Favored 'General case' 0 C--N 1.349 0.586 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 174.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.31 -20.26 62.72 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.165 0.986 . . . . 0.0 113.135 -174.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 16.0 t -67.09 -40.8 86.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 123.527 0.731 . . . . 0.0 111.252 -178.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . 0.493 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 2.4 m-70 -103.49 -38.78 7.02 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 121.051 0.453 . . . . 0.0 109.951 -176.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.1 56.32 1.84 Allowed Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.162 -172.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.493 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 5.8 pt-20 -142.09 161.09 38.88 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.786 1.235 . . . . 0.0 109.531 -178.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -72.68 140.56 47.96 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 pp -114.08 140.21 48.67 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.35 0.66 . . . . 0.0 110.234 -177.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -142.37 95.27 2.77 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 164.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.51 HD11 ' SD ' ' A' ' 125' ' ' MET . 2.5 tm? -169.11 148.28 4.0 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.41 ' N ' HD13 ' A' ' 101' ' ' LEU . 81.0 t80 -132.94 119.11 19.72 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.9 t -79.13 108.26 12.5 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 172.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.572 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 29.5 mt-10 -75.75 -34.82 60.31 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.66 0.384 . . . . 0.0 110.423 -178.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -69.47 -22.82 63.6 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.843 -178.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -111.22 -30.78 7.31 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.61 0.764 . . . . 0.0 110.673 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.48 48.35 10.82 Favored Glycine 0 C--N 1.336 0.539 0 CA-C-N 115.328 -0.851 . . . . 0.0 113.86 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -141.45 146.52 36.61 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.558 0.743 . . . . 0.0 110.857 175.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.416 ' HB1' HD11 ' A' ' 128' ' ' LEU . . . -81.18 107.3 13.85 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.847 0.859 . . . . 0.0 110.83 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.406 ' HB2' HD12 ' A' ' 101' ' ' LEU . 94.0 mt -102.54 -176.26 3.05 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.825 0.85 . . . . 0.0 110.591 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 4.5 p -108.5 159.23 16.86 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 172.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 62.6 t90 -52.38 -39.56 60.99 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.435 0.694 . . . . 0.0 111.937 175.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.594 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 48.2 t -57.91 -52.1 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 123.139 0.576 . . . . 0.0 111.509 179.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 88.9 m -72.92 -19.01 61.34 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 122.568 0.347 . . . . 0.0 111.655 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.408 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -72.19 -57.34 4.32 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 122.841 0.456 . . . . 0.0 110.386 176.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 21.3 mm-40 -74.37 -30.1 61.84 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.46 -173.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 30.8 t . . . . . 0 N--CA 1.469 0.512 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 168.039 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.572 ' HB1' ' HB2' ' A' ' 104' ' ' GLU . . . . . . . . 0 C--O 1.241 0.624 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.51 ' SD ' HD11 ' A' ' 101' ' ' LEU . 5.7 mmt -137.51 121.3 17.52 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.067 0.947 . . . . 0.0 109.472 -175.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.01 141.36 41.51 Favored Pre-proline 0 N--CA 1.489 1.508 0 C-N-CA 123.562 0.745 . . . . 0.0 109.955 176.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -70.23 150.81 65.88 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.457 2.105 . . . . 0.0 112.008 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.416 HD11 ' HB1' ' A' ' 109' ' ' ALA . 95.9 mt . . . . . 0 N--CA 1.475 0.776 0 CA-C-O 121.156 0.503 . . . . 0.0 109.772 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.473 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 11.1 p -73.7 90.04 1.81 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.202 1.001 . . . . 0.0 110.789 -174.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -64.62 101.97 0.52 Allowed 'General case' 0 C--N 1.354 0.776 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 124.42 104.82 1.6 Allowed Glycine 0 C--N 1.343 0.939 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 -173.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -86.43 99.51 11.69 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.516 0.726 . . . . 0.0 109.372 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -87.99 155.82 19.63 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.925 0.89 . . . . 0.0 110.224 178.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.55 100.63 3.94 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 170.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.49 -28.23 66.83 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.934 0.894 . . . . 0.0 112.371 -170.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 86.0 t -59.26 -43.37 89.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 123.565 0.746 . . . . 0.0 111.515 -179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -98.01 -37.81 9.62 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 121.125 0.488 . . . . 0.0 110.443 -176.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.56 49.45 2.75 Favored Glycine 0 C--N 1.343 0.921 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.265 -174.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -138.48 161.64 36.51 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.338 0.655 . . . . 0.0 110.651 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -68.04 137.42 55.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.067 0.947 . . . . 0.0 109.159 170.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.3 pp -111.33 138.34 47.94 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.629 0.372 . . . . 0.0 110.991 -176.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.47 ' HA ' HD12 ' A' ' 128' ' ' LEU . 76.8 m-70 -141.11 96.61 3.03 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.586 0.754 . . . . 0.0 109.169 167.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.622 ' HA ' ' HA ' ' A' ' 127' ' ' PRO . 3.1 tm? -170.28 141.39 2.03 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 106.443 -1.688 . . . . 0.0 106.443 170.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -125.9 111.51 14.89 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 174.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . 0.465 ' SG ' HD12 ' A' ' 110' ' ' LEU . 75.0 m -73.72 112.31 9.7 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 168.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.408 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 27.6 mt-10 -74.13 -37.7 64.01 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 13.5 ptmm? -63.08 -46.98 84.85 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.859 177.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.539 ' HB3' ' HD3' ' A' ' 108' ' ' LYS . 6.9 m-20 -84.61 -28.98 26.13 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.33 0.652 . . . . 0.0 110.648 178.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.57 43.74 91.5 Favored Glycine 0 C--N 1.343 0.953 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.447 -172.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.539 ' HD3' ' HB3' ' A' ' 106' ' ' ASP . 58.4 mtpt -134.33 157.62 45.9 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.818 1.247 . . . . 0.0 109.865 -174.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -103.08 107.9 18.87 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.205 0.602 . . . . 0.0 110.047 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.465 HD12 ' SG ' ' A' ' 103' ' ' CYS . 68.8 mt -107.81 -175.55 2.81 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.896 0.878 . . . . 0.0 110.329 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.451 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 19.6 p -110.43 176.67 4.95 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.015 0.526 . . . . 0.0 110.117 173.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . 0.467 ' O ' ' HG2' ' A' ' 116' ' ' GLN . 51.7 t90 -56.99 -42.4 80.21 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.916 0.76 . . . . 0.0 110.87 173.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.451 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 43.8 t -61.05 -36.45 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 123.558 0.743 . . . . 0.0 111.461 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.456 ' HB2' ' HB3' ' A' ' 110' ' ' LEU . 89.5 m -78.14 -21.82 49.71 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.863 176.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.586 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -72.77 -34.92 67.28 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 170.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 112' ' ' TRP . 12.9 mm100 -79.55 -7.47 58.51 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.325 1.05 . . . . 0.0 111.451 177.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t -64.77 134.4 54.07 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 123.237 0.615 . . . . 0.0 110.839 -178.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 11.3 ptp85 -66.61 -17.14 64.67 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.09 0.956 . . . . 0.0 110.965 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -68.1 -61.07 2.03 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.175 0.99 . . . . 0.0 111.505 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -81.57 111.94 18.34 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 114.323 -1.308 . . . . 0.0 110.55 -162.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -65.1 103.19 0.72 Allowed 'General case' 0 C--N 1.353 0.727 0 C-N-CA 123.939 0.896 . . . . 0.0 110.927 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -64.78 117.33 7.35 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 124.477 1.111 . . . . 0.0 111.205 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 -159.15 -81.2 0.05 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 174.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.454 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . -93.25 72.97 4.58 Favored 'General case' 0 C--N 1.35 0.611 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.457 ' HB3' HD11 ' A' ' 101' ' ' LEU . 23.7 mtm -144.2 119.01 9.88 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.2 m -121.49 137.71 27.33 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 123.929 0.892 . . . . 0.0 109.44 175.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.622 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 32.5 Cg_endo -61.9 155.26 56.01 Favored 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.425 2.083 . . . . 0.0 112.993 177.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.47 HD12 ' HA ' ' A' ' 100' ' ' HIS . 96.7 mt -75.28 93.24 2.84 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.404 0.682 . . . . 0.0 110.276 -177.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -97.78 22.79 8.67 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.985 0.914 . . . . 0.0 112.052 -170.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 . . . . . 0 CA--C 1.546 0.821 0 C-N-CA 123.533 0.733 . . . . 0.0 109.219 -178.251 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.302 0 N-CA-C 113.865 0.306 . . . . 0.0 113.865 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 5.1 t -146.94 139.22 24.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.366 1.066 . . . . 0.0 108.368 175.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -142.13 12.66 2.01 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.3 1.04 . . . . 0.0 110.423 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -58.88 129.37 49.55 Favored Glycine 0 C--N 1.353 1.481 0 CA-C-O 119.446 -0.641 . . . . 0.0 111.84 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -69.68 93.51 0.72 Allowed 'General case' 0 C--N 1.35 0.619 0 CA-C-O 121.806 0.812 . . . . 0.0 110.586 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -107.79 153.16 23.38 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 113.85 -1.523 . . . . 0.0 109.206 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.8 t -61.82 102.36 0.26 Allowed 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.4 -19.66 64.87 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.291 1.036 . . . . 0.0 113.228 -170.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 19.6 t -66.79 -40.8 86.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.443 0.697 . . . . 0.0 111.124 -178.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.434 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.5 m-70 -104.12 -38.22 7.01 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -177.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.35 37.08 5.2 Favored Glycine 0 C--N 1.344 1.002 0 CA-C-N 114.802 -1.09 . . . . 0.0 112.356 -176.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 1.6 pp20? -132.38 153.76 50.46 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.593 0.757 . . . . 0.0 109.969 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -66.1 133.31 50.46 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.692 0.797 . . . . 0.0 111.101 -173.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.5 pp -98.97 146.38 26.08 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.499 0.72 . . . . 0.0 110.041 -174.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -145.96 93.27 2.31 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 164.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.544 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -171.42 138.84 1.21 Allowed 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 173.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -125.84 115.91 20.72 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . 0.609 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 30.5 t -84.54 127.05 33.83 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -178.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -71.87 -45.54 60.96 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.779 0.832 . . . . 0.0 110.985 -175.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -69.61 -32.06 70.56 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.042 0.537 . . . . 0.0 111.273 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.609 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 29.4 t70 -94.08 -27.42 16.28 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.249 1.019 . . . . 0.0 110.818 -171.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.33 34.42 89.87 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-N 115.421 -0.809 . . . . 0.0 113.643 178.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -140.09 162.21 35.77 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.174 0.99 . . . . 0.0 110.084 -175.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -95.96 102.4 14.19 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.747 0.819 . . . . 0.0 110.808 -175.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.497 ' HB2' HD12 ' A' ' 101' ' ' LEU . 74.3 mt -91.54 -176.65 4.57 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.217 1.007 . . . . 0.0 110.499 176.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.4 p -116.29 172.94 6.87 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.15 0.58 . . . . 0.0 110.212 174.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 23.3 t90 -59.41 -47.04 86.98 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.906 0.882 . . . . 0.0 111.781 175.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 39.8 t -57.86 -39.89 73.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 123.561 0.538 . . . . 0.0 110.821 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 99.0 m -79.28 -26.84 42.29 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.106 0.562 . . . . 0.0 111.632 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.544 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -68.02 -37.09 80.99 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.043 0.537 . . . . 0.0 111.118 177.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -106.42 9.16 31.81 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.18 0.592 . . . . 0.0 111.584 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 44.0 t -59.98 143.48 51.62 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.057 0.543 . . . . 0.0 110.248 179.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -66.43 -7.09 17.14 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.431 0.692 . . . . 0.0 112.328 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -74.02 -35.5 64.37 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.348 0.659 . . . . 0.0 111.147 175.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -141.65 -170.73 3.17 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 124.099 0.96 . . . . 0.0 110.347 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -139.94 -179.94 6.25 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.737 0.815 . . . . 0.0 109.23 171.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.738 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 9.4 p-10 -90.81 128.67 36.8 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.381 0.673 . . . . 0.0 110.034 176.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 -152.71 -81.41 0.09 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.847 0.859 . . . . 0.0 109.324 172.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -86.51 74.74 9.85 Favored 'General case' 0 C--N 1.353 0.738 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 177.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.738 ' SD ' ' HA ' ' A' ' 122' ' ' ASP . 2.0 ptm -169.78 129.66 0.99 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.017 -175.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.4 m -107.25 149.99 39.4 Favored Pre-proline 0 N--CA 1.478 0.967 0 C-N-CA 124.724 1.21 . . . . 0.0 109.412 174.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -76.24 140.52 22.24 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 122.432 2.088 . . . . 0.0 112.55 176.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 73.4 mt -79.14 91.97 5.0 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 173.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -105.88 79.31 1.41 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 175.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 . . . . . 0 CA--C 1.549 0.938 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.99 -174.239 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.587 0 N-CA-C 109.79 -1.324 . . . . 0.0 109.79 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.7 p -99.6 -154.45 0.47 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.486 1.114 . . . . 0.0 109.01 171.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.53 18.22 3.43 Favored 'General case' 0 CA--C 1.563 1.476 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 170.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 63.92 43.81 96.96 Favored Glycine 0 C--N 1.354 1.577 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -169.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -66.92 109.45 2.95 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 124.694 1.198 . . . . 0.0 111.444 -168.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 85.0 mtt85 -120.37 151.05 39.8 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 114.271 -1.332 . . . . 0.0 110.198 -175.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -65.69 101.66 0.65 Allowed 'General case' 0 C--N 1.348 0.54 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 174.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.06 -29.12 67.08 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.821 0.848 . . . . 0.0 112.984 -171.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 47.4 t -57.14 -42.5 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 123.816 0.847 . . . . 0.0 111.756 -177.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -104.68 -35.07 7.93 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 -176.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.07 -3.3 55.37 Favored Glycine 0 N--CA 1.476 1.303 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.387 -175.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -83.44 164.31 19.99 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.077 0.951 . . . . 0.0 111.071 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.451 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 41.3 ttp180 -64.5 150.95 45.65 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.065 0.946 . . . . 0.0 110.429 173.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -117.37 141.37 48.4 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.829 0.452 . . . . 0.0 110.275 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 15.9 m80 -149.24 93.83 2.14 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 166.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.499 HD12 ' HB2' ' A' ' 110' ' ' LEU . 3.0 tm? -170.43 143.67 2.33 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 170.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -131.2 104.38 7.03 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 176.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 42.0 t -86.03 118.84 25.75 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 176.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -76.55 -39.68 52.08 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.225 0.61 . . . . 0.0 111.407 -174.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 122' ' ' ASP . 0.0 OUTLIER -67.16 -38.65 85.82 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.926 0.491 . . . . 0.0 111.34 177.752 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -81.51 -29.15 33.71 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.184 0.594 . . . . 0.0 110.129 177.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.2 36.1 92.44 Favored Glycine 0 C--N 1.343 0.96 0 CA-C-N 114.815 -1.084 . . . . 0.0 113.398 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -132.22 145.72 51.52 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 124.212 1.005 . . . . 0.0 109.903 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.72 99.74 9.1 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 171.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.499 ' HB2' HD12 ' A' ' 101' ' ' LEU . 83.9 mt -94.76 -176.75 3.97 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.855 0.862 . . . . 0.0 110.533 -178.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.496 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 7.0 p -113.54 164.49 13.57 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 172.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -59.42 -36.21 75.43 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.708 0.803 . . . . 0.0 111.702 178.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.496 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 84.6 t -60.43 -46.03 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 C-N-CA 123.233 0.613 . . . . 0.0 111.135 178.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.6 m -78.63 -18.11 54.98 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.692 0.397 . . . . 0.0 111.253 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.33 -41.08 57.6 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.282 0.633 . . . . 0.0 110.201 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -78.76 -17.28 56.05 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.619 0.768 . . . . 0.0 110.803 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.5 t -68.22 113.74 6.11 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -75.2 76.03 2.34 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 122.174 0.987 . . . . 0.0 109.725 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -74.31 -56.92 4.32 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 114.614 -1.176 . . . . 0.0 109.953 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -138.37 -80.2 0.34 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 177.69 121.23 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.318 1.047 . . . . 0.0 108.949 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 33.3 t70 -88.44 152.69 21.72 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.169 0.509 . . . . 0.0 110.392 175.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 48.6 m80 -133.92 -12.81 2.54 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.745 1.218 . . . . 0.0 110.065 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -168.57 99.17 0.41 Allowed 'General case' 0 C--N 1.361 1.101 0 C-N-CA 123.792 0.837 . . . . 0.0 110.387 -176.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 15.4 ptp -132.74 124.41 28.07 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 123.425 0.69 . . . . 0.0 109.148 167.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.3 m -104.33 136.85 19.12 Favored Pre-proline 0 CA--C 1.552 1.058 0 C-N-CA 123.731 0.813 . . . . 0.0 109.698 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.27 129.86 16.64 Favored 'Trans proline' 0 C--N 1.372 1.787 0 C-N-CA 122.596 2.197 . . . . 0.0 112.206 178.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 88.7 mt -78.2 121.61 24.59 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -136.95 136.79 38.88 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.053 0.941 . . . . 0.0 108.53 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 . . . . . 0 CA--C 1.553 1.073 0 C-N-CA 123.011 0.525 . . . . 0.0 109.605 -179.927 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.482 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 45.0 p -107.23 113.21 26.48 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.327 0.651 . . . . 0.0 110.569 -177.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -107.22 7.67 29.54 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.885 0.874 . . . . 0.0 110.613 175.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.14 175.31 49.89 Favored Glycine 0 C--N 1.347 1.161 0 O-C-N 123.156 0.285 . . . . 0.0 112.518 -176.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -79.38 74.87 5.99 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.509 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 82.7 mtp180 -125.61 132.87 52.42 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.336 -1.302 . . . . 0.0 109.849 -175.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -65.89 100.48 0.57 Allowed 'General case' 0 C--N 1.355 0.841 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 176.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.53 -24.61 63.82 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.784 0.834 . . . . 0.0 112.475 -173.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.09 -39.98 87.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 124.268 1.027 . . . . 0.0 111.789 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.479 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 1.9 m-70 -105.51 -31.86 8.78 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.18 -10.66 58.36 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-N 115.12 -0.945 . . . . 0.0 112.539 -175.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.479 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 9.4 pt-20 -73.62 179.34 4.18 Favored 'General case' 0 N--CA 1.497 1.893 0 CA-C-N 117.429 0.615 . . . . 0.0 110.31 177.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.509 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 33.5 mtp-105 -69.54 -178.98 1.56 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.689 0.795 . . . . 0.0 111.899 172.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 pp -150.93 145.35 25.55 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.977 173.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 12.7 m170 -152.84 92.95 1.7 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 164.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' A' ' 110' ' ' LEU . 2.6 tm? -170.45 146.76 2.87 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 174.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.464 ' N ' HD13 ' A' ' 101' ' ' LEU . 60.2 t80 -140.36 108.53 5.77 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . 0.658 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 43.6 t -79.77 143.02 34.83 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -76.97 -39.98 48.57 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.281 0.632 . . . . 0.0 111.638 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -79.55 -46.42 17.37 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.436 0.294 . . . . 0.0 111.392 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.658 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 32.1 t70 -66.16 -31.74 72.77 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.173 0.589 . . . . 0.0 109.916 178.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.28 16.18 62.17 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.044 -0.98 . . . . 0.0 114.39 173.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -128.22 168.5 15.37 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.744 0.818 . . . . 0.0 109.257 -178.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -83.64 104.44 13.76 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.957 -1.019 . . . . 0.0 110.474 -177.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.526 ' HB2' HD12 ' A' ' 101' ' ' LEU . 82.9 mt -91.22 -179.01 5.31 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.7 0.8 . . . . 0.0 110.656 174.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.547 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 8.8 p -117.92 162.77 17.59 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 171.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -59.9 -33.89 72.45 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.72 0.808 . . . . 0.0 112.112 178.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.547 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 57.7 t -58.91 -44.0 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 C-N-CA 123.36 0.664 . . . . 0.0 110.786 175.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.452 ' HB3' ' NE2' ' A' ' 120' ' ' HIS . 74.0 m -74.46 -29.06 61.31 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.465 0.706 . . . . 0.0 111.018 177.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.435 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -67.51 -35.21 78.68 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.965 0.506 . . . . 0.0 111.241 178.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -78.03 -26.96 48.71 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.406 0.682 . . . . 0.0 111.111 177.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.9 t -61.48 117.54 5.85 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 123.286 0.634 . . . . 0.0 110.934 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.709 ' HA ' ' HB2' ' A' ' 121' ' ' ARG . 97.2 mtt180 -65.38 -16.82 64.0 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.792 0.837 . . . . 0.0 111.794 178.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -49.04 -49.15 42.62 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.755 1.222 . . . . 0.0 111.442 173.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.452 ' NE2' ' HB3' ' A' ' 114' ' ' CYS . 15.2 p-80 -134.8 50.49 2.16 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-O 122.054 0.93 . . . . 0.0 109.018 177.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.709 ' HB2' ' HA ' ' A' ' 118' ' ' ARG . 36.6 ttt180 -60.7 122.5 14.91 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.401 177.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -146.52 149.24 33.23 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.232 0.539 . . . . 0.0 110.478 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -103.77 -25.32 13.15 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.162 1.385 . . . . 0.0 109.492 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -80.38 72.08 7.23 Favored 'General case' 0 C--N 1.354 0.769 0 CA-C-O 121.933 0.873 . . . . 0.0 109.586 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.1 ptp -148.23 156.47 42.6 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.096 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 31.4 m -125.9 147.07 57.62 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 124.644 1.177 . . . . 0.0 109.67 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.7 128.71 10.35 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 122.203 1.936 . . . . 0.0 112.069 174.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 57.6 mt -76.93 95.02 4.03 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 174.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -164.88 105.87 0.81 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 . . . . . 0 N--CA 1.478 0.954 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 -178.928 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.425 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.4 t -157.0 136.38 12.1 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 123.896 0.878 . . . . 0.0 109.146 173.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -79.1 -75.02 0.26 Allowed 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 177.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 125.5 150.13 7.65 Favored Glycine 0 C--N 1.343 0.95 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 -175.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -89.55 90.93 8.48 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.895 0.878 . . . . 0.0 109.8 -177.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.408 ' HG3' ' HA ' ' A' ' 98' ' ' ARG . 0.0 OUTLIER -122.83 138.34 54.67 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.46 0.704 . . . . 0.0 111.078 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.8 t -67.5 101.35 0.97 Allowed 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 169.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.08 -14.59 60.86 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -167.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 77.9 t -68.34 -46.03 81.48 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 123.059 0.544 . . . . 0.0 111.032 175.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -99.42 -39.54 8.32 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.005 0.431 . . . . 0.0 110.664 -174.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.62 2.52 53.08 Favored Glycine 0 CA--C 1.534 1.25 0 CA-C-N 115.4 -0.818 . . . . 0.0 113.16 -172.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -82.05 152.49 26.6 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 117.307 0.554 . . . . 0.0 109.702 177.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.408 ' HA ' ' HG3' ' A' ' 91' ' ' ARG . 54.1 ttp180 -70.09 119.71 14.69 Favored 'General case' 0 C--O 1.241 0.624 0 C-N-CA 123.561 0.744 . . . . 0.0 109.13 174.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -76.49 136.46 39.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -177.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.3 m80 -154.0 93.82 1.68 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.804 0.841 . . . . 0.0 109.234 172.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.474 HD13 ' N ' ' A' ' 102' ' ' PHE . 3.1 tm? -171.44 150.03 2.79 Favored 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 170.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.474 ' N ' HD13 ' A' ' 101' ' ' LEU . 61.2 t80 -138.68 110.94 7.39 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . 0.456 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 48.6 t -84.19 139.64 32.26 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 174.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -73.33 -53.65 10.28 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 122.723 0.409 . . . . 0.0 110.665 -174.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.97 -34.88 78.99 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.454 0.702 . . . . 0.0 112.513 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.456 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 30.3 t0 -82.83 -33.02 27.26 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 -177.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.36 25.71 67.1 Favored Glycine 0 C--N 1.351 1.397 0 CA-C-N 115.349 -0.842 . . . . 0.0 113.631 179.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -120.25 150.3 40.9 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.132 0.973 . . . . 0.0 109.901 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.26 100.52 11.27 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.149 176.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 28.4 mt -90.93 -178.24 5.16 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.344 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.6 p -112.76 178.08 4.41 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 46.8 t90 -63.41 -51.11 67.17 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.401 0.438 . . . . 0.0 111.872 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 97.5 t -61.7 -45.89 97.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 C-N-CA 123.287 0.635 . . . . 0.0 112.175 -174.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 96.7 m -68.99 -25.3 64.45 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 122.738 0.415 . . . . 0.0 111.838 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -83.96 -51.74 6.9 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 123.113 0.565 . . . . 0.0 111.227 -175.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -81.3 -10.85 59.49 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.734 -172.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 33.5 t -74.77 94.93 2.81 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 161.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -65.77 103.93 0.98 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.971 0.908 . . . . 0.0 112.114 -164.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -122.94 -158.59 0.8 Allowed 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 124.923 1.289 . . . . 0.0 108.461 172.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 9.5 p-80 -73.56 55.57 0.5 Allowed 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 124.918 1.287 . . . . 0.0 112.114 176.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 81.7 mmt-85 -144.9 -36.73 0.3 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.368 1.467 . . . . 0.0 108.478 -178.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.648 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 16.3 t70 -74.19 82.31 1.82 Allowed 'General case' 0 C--N 1.356 0.88 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.348 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -146.28 -65.91 0.29 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -132.09 117.58 18.52 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 174.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.648 ' SD ' ' HA ' ' A' ' 122' ' ' ASP . 15.4 ptm -163.29 117.62 1.63 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.794 0.838 . . . . 0.0 109.409 -170.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 30.2 m -92.05 135.36 27.28 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 122.955 0.502 . . . . 0.0 109.995 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.26 120.65 6.07 Favored 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 122.26 1.974 . . . . 0.0 111.671 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 98.7 mt -70.27 115.87 9.97 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 169.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -125.74 98.81 5.71 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -176.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 . . . . . 0 CA--C 1.548 0.876 0 N-CA-C 108.831 -0.804 . . . . 0.0 108.831 179.557 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.582 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.417 ' HB ' ' HB2' ' A' ' 91' ' ' ARG . 66.6 p -68.58 103.56 1.73 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.413 0.685 . . . . 0.0 109.576 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -70.23 104.17 2.57 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.541 0.736 . . . . 0.0 110.615 -171.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.01 173.7 22.68 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.555 -172.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.67 90.96 0.78 Allowed 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.591 ' HG2' ' HD2' ' A' ' 98' ' ' ARG . 69.4 mtt180 -127.69 136.44 51.58 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.913 0.885 . . . . 0.0 109.922 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.1 t -72.71 100.41 2.82 Favored 'General case' 0 C--N 1.354 0.792 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 175.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.78 -30.12 71.25 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.877 0.871 . . . . 0.0 111.861 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 67.8 t -52.46 -40.5 32.82 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 124.961 1.305 . . . . 0.0 112.314 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -103.99 -37.84 7.21 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.46 24.33 18.94 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 114.953 -1.022 . . . . 0.0 111.815 -171.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -103.33 178.72 4.47 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 171.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.591 ' HD2' ' HG2' ' A' ' 91' ' ' ARG . 4.7 tpt180 -74.93 166.26 23.94 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 123.759 0.824 . . . . 0.0 109.953 173.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.5 pp -133.6 134.7 43.59 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 121.526 -0.734 . . . . 0.0 110.594 174.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.592 ' HA ' HD12 ' A' ' 128' ' ' LEU . 78.7 m-70 -142.17 95.45 2.8 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 166.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.556 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -171.95 154.81 3.61 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 170.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.401 ' N ' HD13 ' A' ' 101' ' ' LEU . 87.9 t80 -135.4 116.09 13.9 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 28.8 t -85.65 124.18 31.9 Favored 'General case' 0 C--N 1.346 0.416 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 177.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -73.71 -44.93 55.08 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.408 0.683 . . . . 0.0 110.969 -173.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.3 -40.65 58.35 Favored 'General case' 0 N--CA 1.486 1.346 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.644 -178.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -78.2 -31.91 49.69 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.253 0.621 . . . . 0.0 110.067 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.18 -19.61 25.82 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.619 -0.719 . . . . 0.0 114.538 174.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -88.24 144.13 26.62 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 117.712 0.756 . . . . 0.0 111.45 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.423 ' HB1' HD11 ' A' ' 128' ' ' LEU . . . -73.4 114.81 12.03 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.738 174.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.48 ' HB2' HD12 ' A' ' 101' ' ' LEU . 82.9 mt -98.93 179.19 4.71 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.74 0.816 . . . . 0.0 110.706 -178.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 8.2 p -99.61 164.1 12.21 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 168.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 63.1 t90 -62.62 -36.01 81.41 Favored 'General case' 0 CA--C 1.548 0.88 0 O-C-N 123.42 0.45 . . . . 0.0 111.325 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 85.0 t -59.77 -40.56 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 C-N-CA 123.256 0.623 . . . . 0.0 111.357 176.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 66.8 m -74.68 -20.81 59.72 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.793 0.437 . . . . 0.0 111.157 177.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.556 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -74.85 -44.0 51.46 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.269 0.628 . . . . 0.0 110.968 176.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -96.24 5.71 50.42 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.983 0.913 . . . . 0.0 111.759 -176.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t -58.24 135.92 57.21 Favored 'General case' 0 C--O 1.245 0.84 0 C-N-CA 123.682 0.793 . . . . 0.0 110.99 -176.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -71.9 87.78 1.02 Allowed 'General case' 0 CA--C 1.543 0.708 0 O-C-N 123.995 0.809 . . . . 0.0 109.052 -177.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -152.08 -55.4 0.13 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.02 1.328 . . . . 0.0 108.059 -170.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -164.63 164.4 21.51 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.173 -1.376 . . . . 0.0 109.253 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -73.18 153.12 40.83 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.288 0.635 . . . . 0.0 110.126 177.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -62.84 125.95 25.68 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 175.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -99.08 -60.32 1.56 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -174.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -145.08 100.98 3.56 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 124.166 0.986 . . . . 0.0 108.915 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 17.6 ptp -155.26 135.4 13.06 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.593 0.757 . . . . 0.0 110.888 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.9 m -114.36 149.98 43.02 Favored Pre-proline 0 N--CA 1.479 0.99 0 C-N-CA 124.665 1.186 . . . . 0.0 108.893 171.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -67.89 152.19 77.4 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.295 1.997 . . . . 0.0 111.89 173.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.592 HD12 ' HA ' ' A' ' 100' ' ' HIS . 63.8 mt -72.1 87.27 1.07 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 170.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -135.89 90.18 2.56 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.673 0.789 . . . . 0.0 108.908 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 . . . . . 0 CA--C 1.551 0.982 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.291 -176.589 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.987 0 CA-C-O 120.713 0.063 . . . . 0.0 112.956 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.8 p -67.63 -18.94 65.15 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.419 1.088 . . . . 0.0 113.226 -176.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -85.37 -21.29 28.93 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.122 0.569 . . . . 0.0 112.283 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.97 -113.53 4.04 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.426 -0.652 . . . . 0.0 112.592 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -66.83 113.86 5.23 Favored 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 46.3 mtm180 -132.69 136.4 46.41 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.777 0.831 . . . . 0.0 111.003 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -74.51 106.42 6.1 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 173.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.68 -17.67 64.12 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -172.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.5 t -67.88 -35.15 71.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.007 0.523 . . . . 0.0 111.359 178.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -107.29 -37.62 6.2 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.196 0.522 . . . . 0.0 109.805 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.18 29.64 12.26 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.058 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -104.72 168.38 9.11 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.281 1.032 . . . . 0.0 109.717 176.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -72.99 124.31 25.22 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 167.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.2 pp -75.91 138.46 41.05 Favored 'General case' 0 C--N 1.357 0.923 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -149.84 94.29 2.15 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.123 0.569 . . . . 0.0 109.531 173.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.549 HD11 ' HB2' ' A' ' 125' ' ' MET . 2.4 tm? -172.24 143.38 1.47 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 105.827 -1.916 . . . . 0.0 105.827 170.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.431 ' N ' HD13 ' A' ' 101' ' ' LEU . 73.9 t80 -127.61 113.62 16.32 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 175.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . 0.535 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 48.8 t -83.29 129.75 35.02 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -178.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -75.01 -41.42 59.42 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.422 0.689 . . . . 0.0 111.452 -175.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -39.57 63.8 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 120.901 0.382 . . . . 0.0 111.113 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.535 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 26.4 t70 -80.6 -30.34 36.83 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.924 0.89 . . . . 0.0 110.687 -178.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.02 8.57 64.86 Favored Glycine 0 C--N 1.343 0.937 0 CA-C-N 115.552 -0.749 . . . . 0.0 114.449 176.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -116.92 -179.71 3.77 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.606 0.763 . . . . 0.0 109.925 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -103.01 109.86 21.56 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.613 0.765 . . . . 0.0 112.084 -172.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.7 mt -93.3 -175.58 3.87 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.857 0.863 . . . . 0.0 110.427 173.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.558 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 0.7 OUTLIER -111.84 149.51 31.7 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 164.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -60.33 -28.45 68.16 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.933 0.493 . . . . 0.0 112.006 -176.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.558 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 71.2 t -61.96 -42.06 93.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.388 0.675 . . . . 0.0 111.277 175.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 89.8 m -75.81 -17.61 59.79 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.009 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.409 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -77.7 -36.88 50.66 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.988 0.515 . . . . 0.0 110.58 169.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -84.57 -3.89 58.69 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.538 0.735 . . . . 0.0 111.414 178.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 46.9 t -73.16 152.81 40.98 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.641 0.777 . . . . 0.0 109.435 169.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -75.99 -26.23 56.54 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 173.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -61.28 101.03 0.14 Allowed 'General case' 0 C--N 1.357 0.904 0 C-N-CA 123.956 0.902 . . . . 0.0 111.372 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 20.5 m80 61.98 29.38 17.73 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.428 1.091 . . . . 0.0 112.15 167.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 25.6 ptt180 -61.81 125.49 24.03 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.578 0.751 . . . . 0.0 111.178 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.428 ' HB2' ' SD ' ' A' ' 125' ' ' MET . 38.3 m-20 -92.69 -174.26 3.59 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.122 -173.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 37.0 t-80 -110.88 -60.11 1.87 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -80.85 89.68 5.85 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.264 177.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.549 ' HB2' HD11 ' A' ' 101' ' ' LEU . 8.2 ptm -155.27 112.33 3.29 Favored 'General case' 0 CA--C 1.555 1.146 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.407 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 34.3 m -96.85 138.63 21.34 Favored Pre-proline 0 N--CA 1.491 1.618 0 C-N-CA 123.502 0.721 . . . . 0.0 111.38 -175.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.434 ' HA ' HD22 ' A' ' 101' ' ' LEU . 58.2 Cg_endo -70.26 123.55 10.04 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.784 2.323 . . . . 0.0 114.312 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 82.7 mt -72.28 122.8 21.73 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 167.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -135.29 68.56 1.46 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.729 0.812 . . . . 0.0 109.5 178.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 . . . . . 0 CA--C 1.556 1.199 0 C-N-CA 123.842 0.857 . . . . 0.0 109.622 178.836 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.701 0 N-CA-C 112.277 -0.329 . . . . 0.0 112.277 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 36.3 p -67.52 -48.08 68.07 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.368 0.667 . . . . 0.0 110.618 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -95.02 112.09 23.83 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 171.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 153.46 105.86 0.27 Allowed Glycine 0 C--N 1.342 0.877 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -76.22 68.18 2.59 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 122.266 1.032 . . . . 0.0 108.719 173.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.508 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 54.2 mtt180 -134.6 136.9 43.26 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.347 -169.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 2.4 t -70.16 99.97 1.58 Allowed 'General case' 0 C--N 1.35 0.595 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 174.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.83 -20.77 65.2 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.451 0.7 . . . . 0.0 112.55 -170.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 50.8 t -63.26 -47.5 91.85 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 124.042 0.937 . . . . 0.0 111.042 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.506 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 0.8 OUTLIER -93.81 -28.2 16.02 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.727 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.53 27.82 31.54 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-N 115.603 -0.726 . . . . 0.0 112.115 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.506 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 9.8 pt-20 -110.27 169.93 8.42 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.835 1.254 . . . . 0.0 108.748 173.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.508 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 45.3 mtm105 -67.89 168.76 11.04 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 121.327 0.584 . . . . 0.0 110.523 168.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.4 pp -124.72 136.74 54.14 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.99 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.517 ' HA ' HD12 ' A' ' 128' ' ' LEU . 75.2 m-70 -143.89 94.02 2.53 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 167.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.778 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 1.8 tm? -171.59 151.56 2.98 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.872 1.669 . . . . 0.0 106.52 171.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.517 ' N ' HD13 ' A' ' 101' ' ' LEU . 38.9 t80 -141.54 124.95 16.59 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 73.4 m -82.3 123.24 28.89 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.163 0.585 . . . . 0.0 109.991 175.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.632 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 10.9 mm-40 -74.88 -30.06 61.19 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 121.286 0.565 . . . . 0.0 111.416 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -89.78 -38.85 13.51 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.659 -176.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -89.72 -31.33 17.51 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.434 0.694 . . . . 0.0 110.743 -178.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.82 41.39 49.69 Favored Glycine 0 C--N 1.342 0.867 0 CA-C-N 115.741 -0.663 . . . . 0.0 113.779 177.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -133.05 144.43 50.02 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.461 0.704 . . . . 0.0 110.777 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.27 100.75 11.43 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.306 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 66.9 mt -92.02 -177.41 4.69 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.448 0.699 . . . . 0.0 110.322 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 5.6 p -103.35 165.79 10.82 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 168.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 49.6 t90 -64.71 -29.85 70.85 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.213 0.605 . . . . 0.0 111.724 -179.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.35 -39.68 84.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 122.839 0.456 . . . . 0.0 110.756 177.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 96.9 m -76.05 -17.09 59.8 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.021 0.529 . . . . 0.0 111.426 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.778 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -75.52 -49.1 19.73 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.213 0.605 . . . . 0.0 110.94 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -85.48 -28.23 25.15 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.441 -173.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 29.4 t -77.74 92.9 4.22 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 166.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -95.3 77.51 3.43 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.531 -166.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -71.2 -61.03 1.92 Allowed 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.025 -0.989 . . . . 0.0 109.436 175.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 2.4 p-80 -165.84 110.54 0.84 Allowed 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.84 0.856 . . . . 0.0 110.526 172.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.549 ' HG2' ' SD ' ' A' ' 125' ' ' MET . 2.7 tpm_? -157.27 -55.72 0.08 Allowed 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 172.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 73.82 107.57 0.07 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 125.436 1.494 . . . . 0.0 114.047 167.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 70.6 t60 84.54 -70.64 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 125.18 1.392 . . . . 0.0 113.518 157.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.632 ' HB1' ' HB2' ' A' ' 104' ' ' GLU . . . -76.16 76.17 2.99 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 121.623 0.725 . . . . 0.0 112.119 -170.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.549 ' SD ' ' HG2' ' A' ' 121' ' ' ARG . 52.7 mmm -127.07 112.38 15.13 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.788 1.235 . . . . 0.0 108.097 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 33.2 m -116.37 151.39 46.83 Favored Pre-proline 0 N--CA 1.493 1.707 0 C-N-CA 123.47 0.708 . . . . 0.0 110.575 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -78.97 137.81 14.11 Favored 'Trans proline' 0 C--N 1.375 1.925 0 C-N-CA 122.719 2.28 . . . . 0.0 113.122 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 100' ' ' HIS . 60.7 mt -71.66 97.05 1.66 Allowed 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 171.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -136.97 46.24 2.2 Favored 'General case' 0 C--O 1.243 0.74 0 CA-C-O 122.567 1.175 . . . . 0.0 108.618 -174.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 10.8 mp0 . . . . . 0 CA--C 1.551 1.014 0 CA-C-N 114.561 -1.199 . . . . 0.0 108.831 176.695 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.117 0 CA-C-O 120.355 -0.136 . . . . 0.0 113.295 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 47.5 m -71.89 102.16 2.83 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 170.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -59.93 123.7 17.89 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.048 0.939 . . . . 0.0 110.594 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -72.97 -96.77 0.08 OUTLIER Glycine 0 C--N 1.341 0.819 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.333 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 58.45 21.13 8.13 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 124.959 1.304 . . . . 0.0 111.805 -177.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -126.39 128.52 47.17 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.837 0.855 . . . . 0.0 109.313 -178.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.4 t -68.59 100.64 1.15 Allowed 'General case' 0 C--N 1.349 0.573 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 174.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.06 -19.82 63.32 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.995 0.918 . . . . 0.0 112.496 -175.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.2 t -62.81 -38.68 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.096 0 C-N-CA 124.173 0.989 . . . . 0.0 111.434 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.431 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 2.1 m-70 -108.09 -39.27 5.55 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 120.88 0.371 . . . . 0.0 110.094 -177.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.42 52.3 2.37 Favored Glycine 0 C--N 1.347 1.166 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.138 -170.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.431 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.0 OUTLIER -146.69 161.21 41.07 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.501 1.12 . . . . 0.0 108.774 176.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 60.5 ttt85 -73.6 139.74 45.74 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.335 0.654 . . . . 0.0 110.995 -178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -105.44 137.16 43.72 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.216 1.007 . . . . 0.0 110.397 -176.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -141.02 93.29 2.57 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 165.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.523 HD11 ' HB3' ' A' ' 125' ' ' MET . 1.6 tm? -172.07 155.7 3.8 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 106.186 -1.783 . . . . 0.0 106.186 170.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.519 ' N ' HD13 ' A' ' 101' ' ' LEU . 33.0 t80 -153.5 121.55 6.11 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 171.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . 0.638 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 46.4 t -96.02 130.65 42.97 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 176.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -67.05 -47.9 69.92 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.612 0.765 . . . . 0.0 110.903 -175.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt -75.96 -35.58 59.61 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -177.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.638 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 10.1 t70 -70.69 -33.11 70.55 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 176.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.42 30.85 78.82 Favored Glycine 0 C--N 1.342 0.902 0 CA-C-N 114.875 -1.057 . . . . 0.0 114.55 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -130.25 149.59 51.88 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.484 0.714 . . . . 0.0 109.585 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.98 100.27 9.6 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.652 -0.869 . . . . 0.0 108.652 174.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 75.5 mt -88.46 176.12 7.31 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.312 -176.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.467 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 12.6 p -115.28 173.13 6.67 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 172.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -59.21 -40.38 85.59 Favored 'General case' 0 CA--C 1.55 0.952 0 O-C-N 123.227 0.329 . . . . 0.0 111.358 176.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.467 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 59.2 t -61.65 -43.5 97.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.494 0.718 . . . . 0.0 111.484 -178.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.1 m -78.72 -18.22 54.64 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.442 0.297 . . . . 0.0 111.282 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.428 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -76.91 -43.94 33.69 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.412 0.685 . . . . 0.0 110.677 176.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -77.53 -16.92 58.4 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.337 0.655 . . . . 0.0 110.59 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 19.5 t -68.25 95.75 0.61 Allowed 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 172.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 54.7 mtp180 -72.31 88.79 1.18 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.217 1.007 . . . . 0.0 110.223 -175.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -121.96 -82.29 0.65 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.185 0.594 . . . . 0.0 111.19 -171.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -166.7 161.46 15.68 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.702 1.201 . . . . 0.0 109.8 -167.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 17.9 mtp180 65.56 25.39 11.73 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 124.353 1.033 . . . . 0.0 111.192 177.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -89.46 87.47 7.09 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.932 0.893 . . . . 0.0 110.218 -175.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -163.42 142.67 8.35 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.172 0.589 . . . . 0.0 110.709 173.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 54.35 58.07 5.28 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.712 1.205 . . . . 0.0 110.6 -177.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.523 ' HB3' HD11 ' A' ' 101' ' ' LEU . 90.0 mtp -101.74 106.46 17.47 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 -176.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 21.1 m -104.77 149.37 37.42 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 124.281 1.032 . . . . 0.0 109.924 -177.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.01 151.4 50.11 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 122.097 1.864 . . . . 0.0 111.092 172.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 45.7 mt -78.43 84.77 4.57 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 121.478 0.656 . . . . 0.0 110.503 177.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -137.58 93.03 2.75 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.688 173.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 . . . . . 0 N--CA 1.478 0.968 0 C-N-CA 123.881 0.872 . . . . 0.0 110.06 -173.435 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.609 0 N-CA-C 111.89 -0.484 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 32.8 p -78.5 80.69 4.87 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-O 121.624 0.726 . . . . 0.0 109.781 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -84.29 155.79 22.24 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.981 -176.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 168.09 -177.69 42.15 Favored Glycine 0 C--N 1.338 0.669 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.326 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.27 32.74 1.9 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.201 1.0 . . . . 0.0 110.913 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -123.51 138.47 54.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.433 0.693 . . . . 0.0 110.739 -176.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.2 t -69.45 102.62 1.83 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.697 0.799 . . . . 0.0 108.967 174.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.8 -8.32 47.22 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.971 0.908 . . . . 0.0 113.148 -173.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 55.0 t -75.07 -38.92 43.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 C-N-CA 123.385 0.674 . . . . 0.0 111.042 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -106.67 -37.25 6.48 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 -176.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.89 32.8 6.64 Favored Glycine 0 N--CA 1.474 1.201 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.092 -173.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -118.74 167.01 12.08 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.608 1.163 . . . . 0.0 109.282 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -71.7 144.32 49.36 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.306 0.643 . . . . 0.0 109.45 172.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -106.33 136.82 45.39 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -144.49 95.4 2.7 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 167.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.452 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.9 tm? -170.35 146.69 2.91 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 170.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.447 ' HB2' HD21 ' A' ' 128' ' ' LEU . 39.1 t80 -140.16 112.96 8.09 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 69.7 m -66.81 115.46 6.62 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.656 0.783 . . . . 0.0 110.231 173.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -69.24 -29.77 67.76 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.014 0.525 . . . . 0.0 111.537 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -84.12 -48.27 10.03 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.139 0.576 . . . . 0.0 111.42 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.91 -16.85 29.13 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.218 0.607 . . . . 0.0 111.073 -170.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.63 35.07 89.34 Favored Glycine 0 C--N 1.347 1.163 0 C-N-CA 123.573 0.606 . . . . 0.0 114.456 175.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -129.45 149.41 51.24 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.634 0.774 . . . . 0.0 110.48 -175.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -95.28 103.05 14.9 Favored 'General case' 0 C--O 1.244 0.786 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.453 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.6 mt -94.36 -179.3 4.87 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.516 177.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 10.6 p -111.43 173.81 6.17 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 171.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 32.2 t90 -59.07 -42.14 89.68 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.159 0.584 . . . . 0.0 111.5 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.75 -41.49 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.212 0 C-N-CA 123.565 0.746 . . . . 0.0 111.714 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 119' ' ' LYS . 85.3 m -78.52 -14.05 59.54 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 122.58 0.352 . . . . 0.0 111.147 177.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.452 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -80.67 -49.27 11.45 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.255 0.622 . . . . 0.0 110.475 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -75.52 -16.94 60.23 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.008 0.923 . . . . 0.0 112.002 -173.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 69.2 p -71.5 -170.75 0.55 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.427 0.691 . . . . 0.0 111.789 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 20.0 tpp85 -68.89 79.16 0.31 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.74 0.816 . . . . 0.0 110.948 -178.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' A' ' 114' ' ' CYS . 0.0 OUTLIER -140.06 -178.56 5.51 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.362 1.465 . . . . 0.0 109.535 -175.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 123' ' ' HIS . 17.1 p-80 -65.98 78.96 0.08 Allowed 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 124.26 1.024 . . . . 0.0 110.673 175.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 13.0 mmm180 -64.59 103.25 0.65 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.689 0.796 . . . . 0.0 112.003 -171.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 66.96 24.78 9.52 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.112 1.365 . . . . 0.0 111.442 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 120' ' ' HIS . 77.4 m80 -107.17 96.5 6.47 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.975 0.91 . . . . 0.0 109.229 176.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 57.43 68.84 0.8 Allowed 'General case' 0 C--O 1.246 0.879 0 C-N-CA 124.577 1.151 . . . . 0.0 111.99 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 21.3 ptm -157.63 116.0 3.15 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.357 -176.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.4 m -103.65 150.03 37.7 Favored Pre-proline 0 N--CA 1.483 1.205 0 C-N-CA 123.843 0.857 . . . . 0.0 110.31 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -80.52 139.6 12.87 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 122.163 1.909 . . . . 0.0 111.698 174.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.447 HD21 ' HB2' ' A' ' 102' ' ' PHE . 74.9 mt -76.07 105.36 7.07 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 120.977 0.417 . . . . 0.0 110.087 178.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -131.82 74.59 1.6 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.445 1.098 . . . . 0.0 109.231 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 . . . . . 0 CA--C 1.554 1.103 0 CA-C-N 114.717 -1.129 . . . . 0.0 110.633 179.25 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.502 0 N-CA-C 111.554 -0.618 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.6 p -89.75 8.89 29.46 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.194 0.998 . . . . 0.0 111.698 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -64.41 96.15 0.15 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.053 0.941 . . . . 0.0 110.581 177.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -69.89 99.28 0.68 Allowed Glycine 0 C--N 1.345 1.049 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.578 178.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -65.97 94.08 0.22 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.783 0.833 . . . . 0.0 110.222 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 65.8 mtm180 -132.28 134.86 45.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.593 1.157 . . . . 0.0 109.578 -175.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -69.09 101.78 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 171.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.51 -7.16 48.61 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.58 0.752 . . . . 0.0 112.603 -172.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -67.25 -50.93 58.37 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 123.484 0.714 . . . . 0.0 110.221 174.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -95.06 -36.99 11.31 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.655 -176.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.48 42.62 4.18 Favored Glycine 0 C--N 1.347 1.149 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.029 -175.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -126.45 156.63 40.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.155 0.982 . . . . 0.0 109.648 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -67.53 128.62 37.12 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.875 0.87 . . . . 0.0 109.771 172.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 pp -97.51 143.56 28.09 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 122.945 0.498 . . . . 0.0 110.565 -178.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -147.55 96.09 2.63 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 164.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.5 tm? -170.26 151.8 3.95 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 106.164 -1.791 . . . . 0.0 106.164 169.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.469 ' N ' HD13 ' A' ' 101' ' ' LEU . 32.7 t80 -137.15 115.84 12.12 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 175.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . 0.637 ' HB3' ' HB2' ' A' ' 106' ' ' ASP . 6.4 t -78.59 134.84 37.17 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.569 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 13.9 mm-40 -77.26 -40.14 45.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.774 0.43 . . . . 0.0 111.113 177.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -74.68 -42.01 59.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.674 0.389 . . . . 0.0 111.181 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.637 ' HB2' ' HB3' ' A' ' 103' ' ' CYS . 1.9 m-20 -81.3 -25.22 36.66 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.999 0.92 . . . . 0.0 110.958 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.23 25.14 69.51 Favored Glycine 0 C--N 1.355 1.611 0 O-C-N 123.383 0.427 . . . . 0.0 113.84 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -132.5 153.98 50.38 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.265 0.626 . . . . 0.0 110.705 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.66 103.41 7.58 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.822 0.849 . . . . 0.0 110.666 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 84.1 mt -94.43 -177.78 4.36 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.109 0.964 . . . . 0.0 110.861 176.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.49 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 4.7 p -112.12 162.59 15.26 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 169.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 78.4 t90 -53.02 -40.43 63.87 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.362 0.665 . . . . 0.0 112.401 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.49 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 62.1 t -60.6 -44.41 96.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 C-N-CA 123.676 0.79 . . . . 0.0 111.266 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.8 m -79.86 -19.45 48.3 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 122.586 0.354 . . . . 0.0 111.739 177.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.534 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -71.18 -53.73 13.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.359 0.664 . . . . 0.0 110.987 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -75.65 -14.6 60.37 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.257 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.8 t -66.59 110.81 3.33 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 123.662 0.785 . . . . 0.0 109.126 174.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -74.46 84.55 1.99 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.515 0.726 . . . . 0.0 110.133 -176.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -84.45 -49.83 8.3 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.585 1.154 . . . . 0.0 109.369 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -132.92 -158.66 0.9 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.534 1.534 . . . . 0.0 107.842 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -77.06 67.13 3.0 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 169.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 47.2 m-20 -75.28 120.27 20.53 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.714 0.806 . . . . 0.0 109.938 -176.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -160.55 -51.42 0.05 OUTLIER 'General case' 0 C--O 1.24 0.576 0 C-N-CA 123.71 0.804 . . . . 0.0 109.44 -172.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.569 ' HB1' ' HB2' ' A' ' 104' ' ' GLU . . . -70.44 93.4 0.88 Allowed 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.43 175.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.3 ptp -159.18 151.13 20.81 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.141 0.977 . . . . 0.0 109.755 176.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 34.7 m -125.62 142.18 41.22 Favored Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 124.37 1.068 . . . . 0.0 109.336 176.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -73.65 126.11 10.57 Favored 'Trans proline' 0 C--N 1.373 1.867 0 C-N-CA 122.037 1.825 . . . . 0.0 111.981 176.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 49.0 mt -72.26 96.4 1.83 Allowed 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -123.04 139.46 54.06 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 173.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 123.593 0.757 . . . . 0.0 109.294 -177.56 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.89 0 CA-C-O 119.757 -0.468 . . . . 0.0 112.331 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.6 m 49.75 71.62 0.38 Allowed 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 125.189 1.395 . . . . 0.0 111.083 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -158.06 -177.41 6.54 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.268 -170.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.86 -130.38 9.67 Favored Glycine 0 C--N 1.347 1.186 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.643 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -142.94 42.8 1.57 Allowed 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 122.175 0.988 . . . . 0.0 109.969 -178.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.424 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 94.0 mtt180 -120.57 138.23 53.99 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 114.66 -1.155 . . . . 0.0 109.679 173.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.9 t -68.98 102.18 1.54 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 173.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.29 -20.52 62.99 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -169.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.5 t -67.24 -47.08 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.226 0.611 . . . . 0.0 111.13 -178.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.547 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.0 OUTLIER -93.62 -38.66 11.23 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -177.079 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.69 36.92 6.64 Favored Glycine 0 C--N 1.35 1.357 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.889 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.547 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.4 OUTLIER -127.86 166.2 18.71 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.059 0.944 . . . . 0.0 109.97 176.453 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.424 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 2.9 tpt180 -71.17 124.87 25.44 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.217 1.007 . . . . 0.0 110.869 -173.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.8 pp -89.19 131.62 35.23 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 178.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -149.96 96.76 2.49 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.259 1.024 . . . . 0.0 108.612 165.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.536 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 3.1 tm? -168.74 149.76 4.64 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 174.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -139.17 118.01 12.4 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . 0.59 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 42.4 t -84.44 123.74 30.57 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 172.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -62.32 -46.93 86.53 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.864 0.865 . . . . 0.0 112.868 -169.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -87.84 -29.84 20.63 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -177.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.59 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 27.2 t70 -72.81 -32.86 65.84 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-O 121.049 0.452 . . . . 0.0 110.586 178.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.46 18.59 73.72 Favored Glycine 0 C--N 1.34 0.783 0 CA-C-N 115.274 -0.875 . . . . 0.0 115.214 173.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -112.53 153.07 28.06 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 117.825 0.813 . . . . 0.0 110.032 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.48 101.03 13.52 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.792 -1.094 . . . . 0.0 108.416 178.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.495 ' HB2' HD12 ' A' ' 101' ' ' LEU . 27.8 mt -91.8 -176.97 4.62 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.096 0.959 . . . . 0.0 109.554 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.628 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 2.9 p -111.19 158.82 18.49 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 171.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -60.9 -33.62 73.4 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.413 0.685 . . . . 0.0 110.997 178.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.628 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 60.4 t -58.55 -43.04 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 C-N-CA 123.585 0.754 . . . . 0.0 111.331 177.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 69.1 m -72.74 -29.87 63.69 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.728 177.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.536 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -68.56 -48.02 65.34 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.276 0.63 . . . . 0.0 111.244 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -78.03 -9.31 59.06 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.579 0.752 . . . . 0.0 112.018 -176.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 39.1 t -56.6 134.36 54.38 Favored 'General case' 0 C--O 1.247 0.948 0 C-N-CA 123.475 0.71 . . . . 0.0 109.894 174.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -64.78 115.5 5.36 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 124.288 0.992 . . . . 0.0 110.743 -172.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -109.81 165.95 11.3 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.419 1.088 . . . . 0.0 112.346 -174.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 3.2 p80 -63.36 -35.68 81.19 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 113.316 -1.765 . . . . 0.0 110.762 166.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -156.01 143.07 19.04 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 123.711 0.804 . . . . 0.0 109.798 -175.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -70.65 140.74 51.63 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.462 0.705 . . . . 0.0 109.43 170.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -126.0 161.8 26.72 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.336 0.654 . . . . 0.0 110.698 -174.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -70.98 98.08 1.55 Allowed 'General case' 0 C--N 1.347 0.468 0 C-N-CA 124.111 0.964 . . . . 0.0 110.503 -177.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.6 ptp -141.73 132.42 25.59 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.499 178.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.5 m -112.13 144.46 30.81 Favored Pre-proline 0 N--CA 1.481 1.119 0 C-N-CA 124.999 1.32 . . . . 0.0 109.9 177.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.64 147.08 50.49 Favored 'Trans proline' 0 C--N 1.375 1.922 0 C-N-CA 122.538 2.159 . . . . 0.0 112.258 178.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 69.9 mt -78.72 92.31 4.77 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.142 0.577 . . . . 0.0 109.824 177.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -104.35 40.64 1.43 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.347 1.059 . . . . 0.0 109.04 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? . . . . . 0 CA--C 1.553 1.08 0 C-N-CA 124.045 0.938 . . . . 0.0 111.699 -175.201 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.691 0 N-CA-C 111.741 -0.543 . . . . 0.0 111.741 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 39.5 m -65.59 104.73 1.07 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 123.588 0.755 . . . . 0.0 109.402 177.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 58.75 76.81 0.33 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.624 1.169 . . . . 0.0 109.365 -170.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -77.84 66.17 3.11 Favored Glycine 0 C--N 1.35 1.324 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.669 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -92.73 27.93 2.2 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.867 1.267 . . . . 0.0 110.007 177.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -128.3 127.88 43.58 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.905 0.882 . . . . 0.0 109.918 -177.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.2 t -68.86 103.29 1.75 Allowed 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -57.63 -23.5 51.49 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -168.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 46.3 t -59.8 -44.98 95.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 123.528 0.731 . . . . 0.0 111.549 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -104.84 -38.75 6.54 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -172.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.09 -6.46 58.24 Favored Glycine 0 C--N 1.349 1.252 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.533 -170.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -67.46 165.0 17.56 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.946 0.898 . . . . 0.0 110.205 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -72.91 132.68 43.79 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 170.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 pp -92.66 129.58 38.55 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 178.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -147.96 95.01 2.42 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 171.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.475 HD11 ' HB3' ' A' ' 125' ' ' MET . 2.9 tm? -171.14 121.32 0.53 Allowed 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 173.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -96.62 111.39 23.55 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 172.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 38.2 t -87.31 108.34 18.92 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -73.64 -19.97 60.7 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -174.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.557 ' HE3' ' SD ' ' A' ' 125' ' ' MET . 21.5 pttp -84.89 -36.43 21.5 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.253 0.621 . . . . 0.0 111.038 177.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -87.69 -26.9 22.74 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.297 0.639 . . . . 0.0 110.048 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.93 17.41 71.54 Favored Glycine 0 C--N 1.343 0.933 0 CA-C-N 115.015 -0.993 . . . . 0.0 113.804 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 108' ' ' LYS . 0.0 OUTLIER -122.71 170.31 10.18 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 123.733 0.813 . . . . 0.0 110.181 -179.243 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.43 108.15 20.07 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.124 -173.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.1 mt -100.9 -177.2 3.39 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.711 1.204 . . . . 0.0 111.334 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 3.0 p -112.9 161.57 16.83 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 43.2 t90 -54.66 -44.15 73.01 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.025 0.93 . . . . 0.0 112.038 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.6 t -60.45 -41.0 85.96 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.661 0.785 . . . . 0.0 111.586 -176.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 97.1 m -75.37 -26.1 58.22 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.653 0.381 . . . . 0.0 111.594 178.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.65 -36.0 62.85 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.19 0.596 . . . . 0.0 111.001 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -94.92 -2.66 50.14 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.602 0.761 . . . . 0.0 111.715 -178.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t -68.42 -175.09 0.6 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.66 0.784 . . . . 0.0 111.41 -178.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 24.6 mmt180 -65.81 -4.42 6.62 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.049 0.94 . . . . 0.0 112.054 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -54.66 -70.68 0.1 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.993 1.317 . . . . 0.0 111.906 174.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 18.6 p-80 -172.9 -177.99 1.74 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.376 1.07 . . . . 0.0 109.97 -169.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -99.85 149.69 23.13 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.306 0.642 . . . . 0.0 109.724 171.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.745 ' HB2' ' HB2' ' A' ' 125' ' ' MET . 10.0 p-10 -82.76 107.4 15.35 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.541 0.737 . . . . 0.0 109.449 171.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 23.2 m-70 -95.38 -62.89 1.22 Allowed 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 175.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -115.59 58.92 0.72 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.745 ' HB2' ' HB2' ' A' ' 122' ' ' ASP . 72.8 mtp -129.33 107.24 9.37 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 106.715 -1.587 . . . . 0.0 106.715 178.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 33.9 m -91.22 161.69 34.3 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.06 0.944 . . . . 0.0 110.006 -173.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -76.11 167.75 25.38 Favored 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 122.173 1.915 . . . . 0.0 112.28 174.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 15.5 mt -112.51 114.02 26.48 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.64 0.776 . . . . 0.0 111.411 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -141.35 56.62 1.53 Allowed 'General case' 0 C--O 1.241 0.646 0 C-N-CA 124.55 1.14 . . . . 0.0 108.142 169.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.55 0.954 0 CA-C-N 114.391 -1.277 . . . . 0.0 108.744 -178.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.255 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 9.5 t -133.56 14.49 4.07 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.102 0.961 . . . . 0.0 110.077 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -70.64 -17.9 62.86 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.026 0.931 . . . . 0.0 112.237 177.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 171.87 -179.01 43.82 Favored Glycine 0 C--N 1.343 0.933 0 N-CA-C 112.147 -0.381 . . . . 0.0 112.147 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.417 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -90.43 40.91 1.03 Allowed 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.186 0.994 . . . . 0.0 110.66 -177.682 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 84.9 mtt85 -110.04 132.38 54.22 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.578 -0.701 . . . . 0.0 110.638 -178.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -62.47 103.06 0.37 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.965 1.306 . . . . 0.0 109.517 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.02 -15.7 35.01 Favored 'General case' 0 N--CA 1.486 1.333 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -166.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 97.8 t -74.61 -43.97 47.38 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 123.16 0.584 . . . . 0.0 111.335 177.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -100.28 -39.91 7.79 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.222 0.534 . . . . 0.0 110.603 -173.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.05 -10.71 60.29 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.555 -168.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -74.28 145.78 43.72 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.632 0.773 . . . . 0.0 109.856 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.453 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 58.3 ttp180 -62.5 144.19 56.3 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.663 0.785 . . . . 0.0 110.894 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 2.7 pp -109.48 141.75 41.48 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 123.635 0.774 . . . . 0.0 110.498 -175.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -148.61 94.46 2.28 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 164.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.459 HD21 ' SD ' ' A' ' 125' ' ' MET . 1.5 tp -170.01 158.55 7.18 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.082 1.353 . . . . 0.0 108.363 172.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.414 ' N ' ' HG ' ' A' ' 101' ' ' LEU . 67.4 t80 -138.05 109.79 7.11 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.831 0.852 . . . . 0.0 109.892 177.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 97.4 m -65.61 110.89 2.91 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.737 0.815 . . . . 0.0 108.966 168.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -76.13 -32.55 59.18 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.876 0.87 . . . . 0.0 110.919 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.537 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 15.2 ptmm? -81.58 -11.94 58.95 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.487 -176.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -131.32 -27.82 1.95 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.614 0.366 . . . . 0.0 111.036 -172.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.96 40.34 21.44 Favored Glycine 0 C--N 1.346 1.089 0 CA-C-N 116.084 -0.507 . . . . 0.0 113.592 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.7 mmmm -120.02 153.61 35.78 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.822 0.849 . . . . 0.0 110.253 179.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.97 106.97 17.97 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.245 0.618 . . . . 0.0 109.729 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 71.7 mt -107.14 -175.74 2.88 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.469 0.707 . . . . 0.0 109.832 178.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.574 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 19.9 p -105.4 167.02 10.02 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 171.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 65.9 t90 -56.56 -36.27 69.13 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 124.236 1.015 . . . . 0.0 111.798 173.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.574 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 60.1 t -59.53 -37.53 70.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 C-N-CA 123.479 0.712 . . . . 0.0 111.385 176.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 59.4 m -72.78 -23.32 60.79 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.894 0.478 . . . . 0.0 110.993 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.473 ' O ' ' HA ' ' A' ' 121' ' ' ARG . . . -87.9 -1.94 58.3 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.599 0.76 . . . . 0.0 111.717 173.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -120.22 12.82 11.88 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.358 0.663 . . . . 0.0 110.398 173.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 42.9 t -69.9 166.1 20.24 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 124.33 1.052 . . . . 0.0 111.916 -175.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 12.1 tpp180 -62.5 -36.74 83.51 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.016 173.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -86.22 -45.49 11.26 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.486 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -123.7 135.87 54.12 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 122.73 0.412 . . . . 0.0 111.721 -172.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.473 ' HA ' ' O ' ' A' ' 115' ' ' ALA . 53.2 ttm-85 -146.46 -79.28 0.16 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.503 0.721 . . . . 0.0 111.002 176.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -103.35 37.87 1.9 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 124.143 0.977 . . . . 0.0 111.435 -166.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 76.3 m-70 -84.88 176.16 8.66 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 175.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.537 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . -67.26 89.81 0.21 Allowed 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.063 0.459 . . . . 0.0 109.881 177.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.459 ' SD ' HD21 ' A' ' 101' ' ' LEU . 15.0 ptp -156.03 129.71 8.42 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 124.36 1.064 . . . . 0.0 109.255 -178.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.4 m -106.29 134.33 19.83 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 123.559 0.744 . . . . 0.0 109.895 175.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.85 120.32 7.24 Favored 'Trans proline' 0 C--N 1.368 1.589 0 C-N-CA 122.309 2.006 . . . . 0.0 110.625 174.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 92.5 mt -73.12 84.98 1.34 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.54 100.27 5.09 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 -178.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 . . . . . 0 CA--C 1.557 1.225 0 C-N-CA 123.778 0.831 . . . . 0.0 109.855 -169.474 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.884 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.2 p -68.1 -24.58 65.05 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.127 0.971 . . . . 0.0 112.976 -173.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -71.39 91.41 1.01 Allowed 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 175.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -103.39 82.76 0.4 Allowed Glycine 0 C--N 1.346 1.095 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.166 -175.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.21 25.16 0.74 Allowed 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 123.992 0.917 . . . . 0.0 110.584 172.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -122.4 134.09 54.62 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 125.749 1.62 . . . . 0.0 108.652 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.445 ' HB2' ' HB3' ' A' ' 111' ' ' CYS . 18.8 t -64.61 103.26 0.65 Allowed 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.0 -19.32 12.14 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -169.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.4 t -69.17 -51.29 44.86 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 123.368 0.667 . . . . 0.0 111.13 179.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -95.39 -38.4 10.51 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-O 121.008 0.432 . . . . 0.0 110.14 -173.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.16 17.79 36.05 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.413 -0.812 . . . . 0.0 113.759 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.425 ' OE2' ' HB3' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -105.4 166.72 10.23 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 117.676 0.738 . . . . 0.0 110.012 174.055 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -68.71 123.99 22.43 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.513 1.125 . . . . 0.0 110.633 -175.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.1 pp -90.7 131.07 36.6 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.495 0.718 . . . . 0.0 109.125 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -143.84 93.77 2.5 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 165.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.641 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.7 tm? -170.11 150.81 3.8 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 170.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.454 ' N ' HD13 ' A' ' 101' ' ' LEU . 84.1 t80 -144.52 110.43 5.39 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 176.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 43.9 t -86.28 112.85 21.78 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 178.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -73.6 -31.37 63.54 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.098 0.959 . . . . 0.0 111.596 -176.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.83 -45.13 21.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.854 0.462 . . . . 0.0 111.111 177.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -79.89 -22.93 42.22 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.622 0.769 . . . . 0.0 109.985 -177.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.72 40.57 93.92 Favored Glycine 0 C--N 1.344 1.027 0 C-N-CA 123.905 0.764 . . . . 0.0 114.146 177.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -132.69 138.78 47.39 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.658 0.783 . . . . 0.0 110.61 177.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.04 100.21 8.06 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 169.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.554 ' HB2' HD12 ' A' ' 101' ' ' LEU . 83.7 mt -95.28 -178.47 4.46 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.67 0.788 . . . . 0.0 111.02 -176.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.456 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 13.7 p -110.74 173.06 6.51 Favored 'General case' 0 C--O 1.244 0.792 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 172.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 73.2 t90 -59.34 -38.7 81.03 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.158 0.583 . . . . 0.0 111.617 175.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.456 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 41.7 t -62.72 -43.04 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 C-N-CA 123.529 0.731 . . . . 0.0 111.101 -178.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.8 m -78.71 -15.54 58.34 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.072 0.549 . . . . 0.0 111.45 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.641 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -78.74 -33.27 46.75 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.38 0.672 . . . . 0.0 110.331 173.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.2 mm-40 -80.57 -27.16 37.54 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.722 0.809 . . . . 0.0 110.274 175.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 48.0 t -68.81 110.72 4.49 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 174.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 50.4 mtp180 -90.64 38.69 0.95 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.257 1.023 . . . . 0.0 110.008 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -56.76 -42.51 79.5 Favored 'General case' 0 C--N 1.357 0.901 0 C-N-CA 124.996 1.318 . . . . 0.0 111.555 -177.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -115.87 -74.01 0.63 Allowed 'General case' 0 C--O 1.24 0.572 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 177.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -172.6 165.74 5.52 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.0 0.92 . . . . 0.0 110.207 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -94.81 -145.12 0.26 Allowed 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 124.769 1.228 . . . . 0.0 108.868 174.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 69.9 m80 77.95 140.93 0.07 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 125.616 1.567 . . . . 0.0 111.164 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 47.42 59.94 3.79 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 124.59 1.156 . . . . 0.0 111.815 176.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.52 ' HB3' HD11 ' A' ' 101' ' ' LEU . 20.9 mtm -136.06 109.95 8.18 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.803 0.841 . . . . 0.0 108.976 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 26.8 m -103.8 132.43 21.05 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 123.647 0.779 . . . . 0.0 110.184 177.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.543 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 49.2 Cg_endo -67.32 141.84 58.0 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.303 2.002 . . . . 0.0 111.137 175.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 86.7 mt -75.14 100.6 4.31 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.127 0.489 . . . . 0.0 110.031 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -120.12 67.31 0.83 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 174.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 . . . . . 0 CA--C 1.558 1.283 0 C-N-CA 125.524 1.53 . . . . 0.0 110.16 -178.633 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.784 0 N-CA-C 110.789 -0.924 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 23.9 m -63.03 93.52 0.06 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.106 0.963 . . . . 0.0 111.868 -172.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.493 ' HB3' ' HB2' ' A' ' 91' ' ' ARG . 78.5 mm-40 -82.9 109.71 17.26 Favored 'General case' 0 C--O 1.242 0.705 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.843 175.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -74.43 -112.14 0.08 OUTLIER Glycine 0 C--N 1.35 1.322 0 N-CA-C 111.925 -0.47 . . . . 0.0 111.925 176.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.472 ' O ' ' HG ' ' A' ' 99' ' ' LEU . 2.3 mp0 -83.54 64.8 8.1 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 168.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.522 ' HG2' ' HA ' ' A' ' 98' ' ' ARG . 32.8 mtp85 -130.86 131.45 44.57 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.622 0.769 . . . . 0.0 110.056 -173.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 4.5 t -69.46 101.47 1.58 Allowed 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.71 -10.76 55.26 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -169.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 60.8 t -68.73 -51.44 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.54 0.736 . . . . 0.0 110.558 175.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -89.5 -31.84 17.47 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 -178.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.71 -0.37 67.48 Favored Glycine 0 C--N 1.351 1.416 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.123 -175.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -78.55 159.07 28.34 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.915 0.886 . . . . 0.0 111.086 -178.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.522 ' HA ' ' HG2' ' A' ' 91' ' ' ARG . 7.9 tpt180 -71.98 132.58 44.49 Favored 'General case' 0 CA--C 1.552 1.02 0 O-C-N 124.011 0.819 . . . . 0.0 109.158 167.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 90' ' ' GLU . 4.1 pp -101.2 148.62 24.88 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 122.932 0.493 . . . . 0.0 110.17 -177.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.428 ' HA ' HD12 ' A' ' 128' ' ' LEU . 66.5 m80 -144.91 94.88 2.6 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 123.945 0.778 . . . . 0.0 109.096 167.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.602 ' HA ' ' HA ' ' A' ' 127' ' ' PRO . 3.2 tm? -170.43 115.4 0.48 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 173.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -95.16 113.17 24.82 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 35.8 t -85.43 112.92 21.31 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 174.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -75.87 -32.84 59.89 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.581 0.753 . . . . 0.0 111.612 -174.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 124' ' ' ALA . 21.2 ptmt -74.62 -39.51 62.09 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.711 0.404 . . . . 0.0 111.177 178.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -86.18 -26.59 25.04 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.616 0.766 . . . . 0.0 109.707 -177.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.41 27.19 73.04 Favored Glycine 0 C--N 1.341 0.857 0 C-N-CA 124.126 0.869 . . . . 0.0 113.811 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -131.73 152.99 50.51 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.73 0.812 . . . . 0.0 110.703 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.33 100.24 11.13 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.215 178.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.473 ' HB2' HD12 ' A' ' 101' ' ' LEU . 21.1 mt -89.61 -177.71 5.36 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.761 0.824 . . . . 0.0 109.893 175.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.52 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 1.3 p -112.44 160.72 17.47 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 173.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 47.5 t90 -52.28 -43.3 64.35 Favored 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 124.592 1.157 . . . . 0.0 112.253 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.52 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 95.7 t -59.16 -46.98 91.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 123.55 0.74 . . . . 0.0 111.594 -179.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 71.4 m -79.28 -14.76 58.81 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.668 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.481 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -82.16 -39.52 23.1 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.565 0.746 . . . . 0.0 110.65 177.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -91.83 14.75 14.59 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.205 0.602 . . . . 0.0 110.673 176.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 47.0 t -74.41 161.78 29.49 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.779 0.832 . . . . 0.0 110.304 169.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -61.66 -24.85 67.01 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.536 0.734 . . . . 0.0 111.452 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 21.2 tptp -63.06 -29.66 70.99 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.425 0.69 . . . . 0.0 112.141 178.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -125.02 161.73 26.09 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.246 0.619 . . . . 0.0 110.995 -176.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -139.61 -75.28 0.36 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.24 1.016 . . . . 0.0 108.934 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -170.95 101.06 0.22 Allowed 'General case' 0 C--O 1.239 0.518 0 N-CA-C 106.363 -1.717 . . . . 0.0 106.363 -177.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -127.75 -61.85 1.1 Allowed 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -168.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.402 ' HB3' ' HB3' ' A' ' 105' ' ' LYS . . . -175.08 86.27 0.04 OUTLIER 'General case' 0 C--O 1.237 0.408 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 177.3 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.544 ' HB2' HD11 ' A' ' 101' ' ' LEU . 9.3 ptm -167.11 110.94 0.71 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.768 0.827 . . . . 0.0 109.959 -169.314 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.6 m -116.26 136.86 23.12 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.839 1.255 . . . . 0.0 110.063 -178.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . 0.602 ' HA ' ' HA ' ' A' ' 101' ' ' LEU . 28.6 Cg_endo -61.31 142.64 96.68 Favored 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.665 2.243 . . . . 0.0 113.124 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 100' ' ' HIS . 93.2 mt -68.61 108.9 3.53 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.35 0.66 . . . . 0.0 109.503 175.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.14 64.34 8.33 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.4 0.68 . . . . 0.0 110.403 -178.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 . . . . . 0 N--CA 1.475 0.821 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.498 -179.67 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.703 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 34.1 m -61.76 -36.99 82.64 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.647 0.779 . . . . 0.0 110.731 -178.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -87.95 44.73 1.21 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.287 1.035 . . . . 0.0 110.565 175.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -67.85 91.87 0.23 Allowed Glycine 0 C--N 1.348 1.198 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -68.23 78.44 0.25 Allowed 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.45 1.1 . . . . 0.0 110.505 -176.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.427 ' HA ' ' HA ' ' A' ' 98' ' ' ARG . 76.2 mtp180 -124.17 133.88 53.45 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.285 0.634 . . . . 0.0 110.998 -170.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 6.1 t -67.46 100.41 0.85 Allowed 'General case' 0 C--N 1.349 0.572 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 171.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.45 -13.7 62.27 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -168.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 98.8 t -61.93 -43.98 98.25 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 C-N-CA 123.21 0.604 . . . . 0.0 111.25 173.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -104.37 -38.02 6.99 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 121.508 0.671 . . . . 0.0 109.814 -176.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.79 -3.29 52.69 Favored Glycine 0 CA--C 1.532 1.133 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.616 -172.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.55 157.45 33.87 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 118.159 0.98 . . . . 0.0 109.911 177.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.427 ' HA ' ' HA ' ' A' ' 91' ' ' ARG . 36.1 ttp-105 -72.43 124.09 24.45 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 173.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -83.95 134.84 34.64 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.423 0.689 . . . . 0.0 109.584 -177.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -146.41 94.77 2.5 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 168.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.553 HD11 ' SD ' ' A' ' 125' ' ' MET . 2.4 tm? -171.79 153.46 3.32 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 171.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.467 ' N ' HD13 ' A' ' 101' ' ' LEU . 77.1 t80 -143.81 120.06 10.85 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 173.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 44.7 t -82.69 125.64 31.46 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -69.45 -32.4 71.32 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.061 0.944 . . . . 0.0 112.106 -177.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.95 -41.55 11.07 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.716 0.407 . . . . 0.0 111.459 -178.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.427 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 37.0 t70 -78.85 -28.43 44.27 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.257 0.623 . . . . 0.0 110.723 -177.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.54 35.85 62.71 Favored Glycine 0 C--N 1.351 1.392 0 CA-C-N 116.027 -0.533 . . . . 0.0 114.22 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -133.67 147.09 51.39 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.328 0.651 . . . . 0.0 111.58 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.96 100.51 9.72 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.516 176.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 77.4 mt -100.62 -175.79 3.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.173 0.989 . . . . 0.0 111.008 -176.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.421 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 10.1 p -110.68 170.84 7.82 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 168.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 82.9 t90 -57.24 -47.01 82.44 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.807 0.443 . . . . 0.0 111.653 174.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.421 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 71.1 t -55.28 -47.61 77.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 C-N-CA 123.916 0.886 . . . . 0.0 112.387 -175.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 74.4 m -76.68 -19.72 57.42 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.548 0.339 . . . . 0.0 111.554 -178.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -81.21 -34.37 32.28 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.42 0.629 . . . . 0.0 110.567 177.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -114.45 17.56 17.33 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.252 -170.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 38.7 t -70.81 165.41 23.22 Favored 'General case' 0 C--O 1.244 0.774 0 C-N-CA 123.408 0.683 . . . . 0.0 110.302 175.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -60.57 138.99 57.97 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 80.26 -41.01 0.2 Allowed 'General case' 0 N--CA 1.498 1.959 0 C-N-CA 125.314 1.446 . . . . 0.0 110.912 -175.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -65.31 100.89 0.51 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.662 0.785 . . . . 0.0 109.032 175.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -85.33 157.18 20.61 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.622 0.769 . . . . 0.0 111.278 -171.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.62 102.77 2.34 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.213 0.605 . . . . 0.0 109.768 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 9.9 p-80 -123.63 -158.17 0.79 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.546 1.138 . . . . 0.0 108.604 173.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.64 89.36 0.15 Allowed 'General case' 0 CA--C 1.551 1.004 0 CA-C-O 121.399 0.619 . . . . 0.0 111.136 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.553 ' SD ' HD11 ' A' ' 101' ' ' LEU . 7.0 mmt -121.05 119.78 33.46 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.099 1.36 . . . . 0.0 108.374 177.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 36.0 m -117.7 145.71 37.08 Favored Pre-proline 0 N--CA 1.488 1.451 0 C-N-CA 123.703 0.801 . . . . 0.0 110.826 -176.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -70.66 151.63 64.07 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.869 2.379 . . . . 0.0 113.377 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 87.3 mt -94.39 134.09 37.27 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 168.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.19 165.99 23.81 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.07 0.948 . . . . 0.0 108.78 172.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 -175.574 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.394 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.9 t -148.44 -174.56 4.63 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.664 0.786 . . . . 0.0 110.056 -176.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -67.27 -179.9 1.1 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.28 1.032 . . . . 0.0 111.83 176.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -75.63 76.11 1.37 Allowed Glycine 0 C--N 1.348 1.208 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 173.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.516 ' HG3' ' HG3' ' A' ' 91' ' ' ARG . 6.3 pt-20 -84.55 -16.47 42.15 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.028 0.931 . . . . 0.0 111.305 176.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.516 ' HG3' ' HG3' ' A' ' 90' ' ' GLU . 60.9 mtt85 -118.96 136.09 54.26 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.476 1.111 . . . . 0.0 108.763 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 8.8 t -69.71 102.0 1.8 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 173.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.73 -20.03 63.06 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -170.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.3 t -62.53 -40.34 87.85 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.299 0 C-N-CA 123.973 0.909 . . . . 0.0 111.651 177.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.49 ' HB2' ' HG3' ' A' ' 97' ' ' GLU . 1.3 m-70 -107.59 -38.23 5.96 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.16 0.505 . . . . 0.0 110.095 -177.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.31 25.65 15.85 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.457 -0.792 . . . . 0.0 113.2 -176.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.49 ' HG3' ' HB2' ' A' ' 95' ' ' HIS . 0.0 OUTLIER -113.36 152.49 29.9 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.608 0.763 . . . . 0.0 109.535 174.13 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -70.21 122.94 20.45 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.315 0.646 . . . . 0.0 109.688 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.6 pp -80.97 138.61 36.08 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.985 -171.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -144.79 98.12 3.13 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.547 0.739 . . . . 0.0 109.78 167.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.686 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 1.9 tm? -168.28 143.09 3.48 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 105.243 -2.132 . . . . 0.0 105.243 169.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.407 ' N ' HD13 ' A' ' 101' ' ' LEU . 37.9 t80 -129.69 115.23 17.03 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . 0.43 ' SG ' ' HG2' ' A' ' 105' ' ' LYS . 47.5 t -97.02 131.97 43.3 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.378 0.671 . . . . 0.0 109.386 179.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -74.3 -52.21 12.94 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.004 0.922 . . . . 0.0 111.121 -178.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.43 ' HG2' ' SG ' ' A' ' 103' ' ' CYS . 14.8 ptmm? -63.07 -38.66 92.07 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.042 0.537 . . . . 0.0 111.06 -176.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -83.66 -29.66 27.45 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.7 0.8 . . . . 0.0 109.857 -178.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.19 34.71 88.97 Favored Glycine 0 C--N 1.346 1.131 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.518 179.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -132.7 147.35 52.33 Favored 'General case' 0 C--O 1.242 0.67 0 C-N-CA 123.44 0.696 . . . . 0.0 110.738 -172.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -84.23 99.99 10.91 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 114.333 -1.303 . . . . 0.0 108.341 172.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 59.8 mt -93.9 -177.3 4.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.023 0.929 . . . . 0.0 110.242 179.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.505 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 2.8 p -108.9 159.68 16.61 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 173.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 50.6 t90 -58.85 -33.92 71.0 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.281 0.632 . . . . 0.0 111.765 177.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.505 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 28.6 t -63.69 -43.47 98.09 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.312 0 C-N-CA 123.622 0.769 . . . . 0.0 111.021 -179.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 91.5 m -77.73 -17.91 57.09 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 122.936 0.494 . . . . 0.0 111.186 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.686 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -73.52 -40.65 63.87 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 122.844 0.458 . . . . 0.0 110.304 170.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -87.19 -9.94 53.9 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.524 0.73 . . . . 0.0 112.369 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 80.4 p -72.72 108.99 6.01 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 168.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.9 ttt180 -77.42 10.08 2.8 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 122.804 0.442 . . . . 0.0 111.881 -169.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -62.6 -17.49 60.3 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.481 0.713 . . . . 0.0 111.011 163.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 46.7 m80 -104.4 -177.35 3.34 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.572 1.149 . . . . 0.0 108.79 174.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 -143.46 140.18 30.24 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 122.913 0.485 . . . . 0.0 109.768 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.84 98.94 0.21 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.321 1.048 . . . . 0.0 110.467 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -141.53 92.82 2.5 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 56.73 61.83 2.5 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.6 1.16 . . . . 0.0 111.321 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 84.0 mtp -122.24 109.1 14.05 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 27.5 m -108.03 162.71 18.91 Favored Pre-proline 0 N--CA 1.48 1.05 0 C-N-CA 124.488 1.115 . . . . 0.0 109.303 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -66.82 150.35 83.28 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 121.787 1.658 . . . . 0.0 110.877 171.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.468 ' HB2' ' N ' ' A' ' 101' ' ' LEU . 1.7 tt -69.37 97.24 0.95 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -178.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -145.48 130.45 18.28 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.053 0.941 . . . . 0.0 108.474 175.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 . . . . . 0 CA--C 1.553 1.064 0 C-N-CA 123.739 0.816 . . . . 0.0 110.119 179.649 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.097 0 N-CA-C 113.503 0.161 . . . . 0.0 113.503 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.7 t -90.68 -1.72 57.86 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.375 0.67 . . . . 0.0 110.682 175.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 56.4 71.23 0.58 Allowed 'General case' 0 C--N 1.358 0.963 0 C-N-CA 124.62 1.168 . . . . 0.0 109.498 -168.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -77.16 47.51 2.63 Favored Glycine 0 C--N 1.352 1.458 0 CA-C-N 116.014 -0.539 . . . . 0.0 113.103 178.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -94.67 5.53 51.59 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.77 1.228 . . . . 0.0 109.898 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 59.2 mtm-85 -115.34 135.0 54.59 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.843 1.257 . . . . 0.0 108.796 174.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.409 ' HB3' ' OE2' ' A' ' 97' ' ' GLU . 10.3 t -69.42 102.07 1.7 Allowed 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 176.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -50.66 -30.13 12.82 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.842 1.257 . . . . 0.0 113.906 -172.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.71 -42.87 96.23 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.071 0 C-N-CA 123.421 0.689 . . . . 0.0 112.002 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.9 -37.79 8.09 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-O 120.997 0.427 . . . . 0.0 110.21 -175.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 100.91 3.88 54.64 Favored Glycine 0 C--N 1.346 1.108 0 CA-C-N 115.472 -0.786 . . . . 0.0 113.844 178.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.409 ' OE2' ' HB3' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -94.79 166.46 11.97 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-N 117.765 0.782 . . . . 0.0 109.882 177.376 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -73.09 120.91 19.38 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.039 0.535 . . . . 0.0 110.142 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.9 pp -80.17 136.99 36.61 Favored 'General case' 0 C--N 1.349 0.551 0 C-N-CA 123.711 0.804 . . . . 0.0 109.587 -179.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -145.0 95.01 2.62 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 166.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.532 ' HG ' ' HB2' ' A' ' 115' ' ' ALA . 2.6 tm? -172.16 149.3 2.29 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 168.117 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.476 ' HB2' HD21 ' A' ' 128' ' ' LEU . 79.0 t80 -130.5 114.23 15.24 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 172.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . 0.536 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 41.1 t -84.22 120.15 25.87 Favored 'General case' 0 C--O 1.227 -0.103 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 177.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -70.87 -39.59 72.79 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.613 0.765 . . . . 0.0 111.152 -172.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.534 ' HE2' ' HB3' ' A' ' 121' ' ' ARG . 0.0 OUTLIER -76.44 -34.47 58.76 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.224 -178.369 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.536 ' HB3' ' HB3' ' A' ' 103' ' ' CYS . 32.6 t70 -84.93 -26.62 27.11 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.011 0.924 . . . . 0.0 110.318 -179.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.65 13.96 69.27 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-N 114.373 -1.285 . . . . 0.0 114.81 176.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -113.98 150.02 34.46 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-N 117.415 0.607 . . . . 0.0 110.45 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.21 101.32 7.03 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.697 -1.138 . . . . 0.0 108.697 174.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 75.7 mt -94.92 -177.28 4.11 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.813 0.845 . . . . 0.0 110.58 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.611 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 9.7 p -111.81 168.25 9.73 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 173.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 26.4 t90 -65.04 -32.14 73.72 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 122.745 0.418 . . . . 0.0 111.197 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.611 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 44.2 t -59.43 -46.36 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 C-N-CA 123.681 0.792 . . . . 0.0 110.909 177.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 83.2 m -79.41 -19.2 50.6 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.895 0.478 . . . . 0.0 111.348 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.532 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -71.36 -49.44 42.26 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.188 0.595 . . . . 0.0 110.618 177.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -77.31 -18.42 57.51 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.28 0.632 . . . . 0.0 111.187 177.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 35.8 t -65.17 142.36 58.36 Favored 'General case' 0 C--N 1.355 0.826 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 173.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -65.79 121.39 14.92 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 123.988 0.805 . . . . 0.0 111.425 -170.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.479 ' HB2' ' HB3' ' A' ' 122' ' ' ASP . 0.0 OUTLIER -113.74 163.18 15.37 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 123.911 0.884 . . . . 0.0 109.948 178.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -60.94 -28.57 69.06 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.517 1.127 . . . . 0.0 111.114 175.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.534 ' HB3' ' HE2' ' A' ' 105' ' ' LYS . 28.3 tpt180 -165.94 91.44 0.48 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.546 1.138 . . . . 0.0 108.13 -177.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.479 ' HB3' ' HB2' ' A' ' 119' ' ' LYS . 3.5 p-10 -109.09 111.05 22.48 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.354 0.662 . . . . 0.0 110.618 -178.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -166.92 -46.88 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.811 0.844 . . . . 0.0 109.813 175.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -72.88 89.29 1.38 Allowed 'General case' 0 C--N 1.354 0.793 0 C-N-CA 123.637 0.775 . . . . 0.0 109.964 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 17.9 ptp -161.85 142.27 10.47 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.184 0.994 . . . . 0.0 109.949 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 17.4 m -127.96 150.17 72.85 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.039 1.336 . . . . 0.0 109.868 179.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -74.32 140.81 27.97 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 122.504 2.136 . . . . 0.0 112.383 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.476 HD21 ' HB2' ' A' ' 102' ' ' PHE . 74.8 mt -87.9 92.29 9.07 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 174.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -114.74 81.18 1.52 Allowed 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 171.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 . . . . . 0 CA--C 1.544 0.736 0 C-N-CA 124.374 1.069 . . . . 0.0 109.833 -172.637 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.9 0 N-CA-C 111.813 -0.515 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.8 p -99.42 90.37 4.51 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 121.424 0.63 . . . . 0.0 110.686 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.14 167.18 31.24 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.814 0.846 . . . . 0.0 109.796 177.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 73.92 73.18 0.93 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.182 177.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -62.4 122.15 15.0 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 171.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -129.34 135.27 48.52 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.75 0.42 . . . . 0.0 111.597 -172.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 5.9 t -73.16 102.05 3.49 Favored 'General case' 0 C--N 1.349 0.586 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 174.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.31 -20.26 62.72 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.165 0.986 . . . . 0.0 113.135 -174.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 16.0 t -67.09 -40.8 86.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 C-N-CA 123.527 0.731 . . . . 0.0 111.252 -178.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.493 ' HB2' ' HG2' ' A' ' 97' ' ' GLU . 2.4 m-70 -103.49 -38.78 7.02 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 121.051 0.453 . . . . 0.0 109.951 -176.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.1 56.32 1.84 Allowed Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.162 -172.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.493 ' HG2' ' HB2' ' A' ' 95' ' ' HIS . 5.8 pt-20 -142.09 161.09 38.88 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.786 1.235 . . . . 0.0 109.531 -178.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -72.68 140.56 47.96 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 4.1 pp -114.08 140.21 48.67 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.35 0.66 . . . . 0.0 110.234 -177.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -142.37 95.27 2.77 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 164.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.51 HD11 ' SD ' ' A' ' 125' ' ' MET . 2.5 tm? -169.11 148.28 4.0 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.41 ' N ' HD13 ' A' ' 101' ' ' LEU . 81.0 t80 -132.94 119.11 19.72 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.9 t -79.13 108.26 12.5 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 106.947 -1.501 . . . . 0.0 106.947 172.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.572 ' HB2' ' HB1' ' A' ' 124' ' ' ALA . 29.5 mt-10 -75.75 -34.82 60.31 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.66 0.384 . . . . 0.0 110.423 -178.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -69.47 -22.82 63.6 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.843 -178.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -111.22 -30.78 7.31 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.61 0.764 . . . . 0.0 110.673 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.48 48.35 10.82 Favored Glycine 0 C--N 1.336 0.539 0 CA-C-N 115.328 -0.851 . . . . 0.0 113.86 -177.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -141.45 146.52 36.61 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.558 0.743 . . . . 0.0 110.857 175.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.416 ' HB1' HD11 ' A' ' 128' ' ' LEU . . . -81.18 107.3 13.85 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.847 0.859 . . . . 0.0 110.83 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.406 ' HB2' HD12 ' A' ' 101' ' ' LEU . 94.0 mt -102.54 -176.26 3.05 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.825 0.85 . . . . 0.0 110.591 179.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 113' ' ' VAL . 4.5 p -108.5 159.23 16.86 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 172.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 62.6 t90 -52.38 -39.56 60.99 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.435 0.694 . . . . 0.0 111.937 175.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.594 ' HB ' ' SG ' ' A' ' 111' ' ' CYS . 48.2 t -57.91 -52.1 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 123.139 0.576 . . . . 0.0 111.509 179.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 88.9 m -72.92 -19.01 61.34 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 122.568 0.347 . . . . 0.0 111.655 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.408 ' HB2' ' HG ' ' A' ' 101' ' ' LEU . . . -72.19 -57.34 4.32 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 122.841 0.456 . . . . 0.0 110.386 176.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 21.3 mm-40 -74.37 -30.1 61.84 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.46 -173.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 30.8 t -73.65 94.45 2.19 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 168.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -133.32 147.2 51.86 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 -174.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -62.02 -51.03 69.65 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 177.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -104.53 -88.37 0.43 Allowed 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 172.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.589 ' HD3' ' H ' ' A' ' 122' ' ' ASP . 6.3 tpp180 -163.09 151.28 13.82 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.072 0.549 . . . . 0.0 110.497 -178.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.589 ' H ' ' HD3' ' A' ' 121' ' ' ARG . 2.4 m-20 -50.83 149.52 3.4 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.359 1.464 . . . . 0.0 112.379 178.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -125.26 -67.16 0.91 Allowed 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.568 0.747 . . . . 0.0 109.805 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.572 ' HB1' ' HB2' ' A' ' 104' ' ' GLU . . . -124.44 92.68 3.71 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -177.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.51 ' SD ' HD11 ' A' ' 101' ' ' LEU . 5.7 mmt -137.51 121.3 17.52 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.067 0.947 . . . . 0.0 109.472 -175.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 17.1 m -129.01 141.36 41.51 Favored Pre-proline 0 N--CA 1.489 1.508 0 C-N-CA 123.562 0.745 . . . . 0.0 109.955 176.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -70.23 150.81 65.88 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.457 2.105 . . . . 0.0 112.008 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.416 HD11 ' HB1' ' A' ' 109' ' ' ALA . 95.9 mt -80.85 86.0 6.08 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.156 0.503 . . . . 0.0 109.772 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -95.84 52.83 1.36 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.247 1.019 . . . . 0.0 110.656 -176.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 . . . . . 0 CA--C 1.551 0.994 0 CA-C-N 114.506 -1.225 . . . . 0.0 109.67 -174.851 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_